USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 748 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 1 MET N :NH3+ -152:sc= 0.041 (180deg=0) USER MOD Set 1.2: B 35 ASN : amide:sc= 0.0394 K(o=0.08,f=-3.5!) USER MOD Set 2.1: B 13 ASN : amide:sc= -0.0604 K(o=-0.06,f=-0.76!) USER MOD Set 2.2: B 19 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: B 11 SER OG : rot -90:sc= 0.111 USER MOD Set 3.2: B 21 THR OG1 : rot 180:sc= 0.0994 USER MOD Set 4.1: A 29 GLN : amide:sc= -1.55! C(o=-1.6!,f=-6.3!) USER MOD Set 4.2: B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 35 ASN : amide:sc= 0 K(o=0.056,f=-0.86) USER MOD Set 5.2: B 1 MET N :NH3+ 136:sc= 0.056 (180deg=0) USER MOD Set 6.1: A 13 ASN : amide:sc=-0.00798 K(o=-0.013,f=1.2) USER MOD Set 6.2: A 19 THR OG1 : rot 180:sc= -0.005 USER MOD Set 7.1: A 11 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 21 THR OG1 : rot 180:sc= -0.0521 USER MOD Single : A 1 MET CE :methyl -164:sc= -0.401 (180deg=-1.03) USER MOD Single : A 5 THR OG1 : rot 110:sc= 0.157 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 8:sc= 0.24 USER MOD Single : A 28 GLN : amide:sc= -0.267 K(o=-0.27,f=-2.1!) USER MOD Single : A 38 LYS NZ :NH3+ 166:sc= -0.0192 (180deg=-0.242) USER MOD Single : A 43 HIS : no HD1:sc= -0.637 X(o=-0.64,f=-0.19) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 176:sc= 0 (180deg=-0.0424) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 SER OG : rot 180:sc= 0 USER MOD Single : B 28 GLN : amide:sc= -0.192 K(o=-0.19,f=-1.7) USER MOD Single : B 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 38 LYS NZ :NH3+ 167:sc=-0.00842 (180deg=-0.2) USER MOD Single : B 43 HIS : no HD1:sc= -0.207 X(o=-0.21,f=-0.2) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 23.654 -2.179 -6.816 1.00 0.00 N ATOM 2 CA MET A 1 22.568 -1.429 -7.472 1.00 0.00 C ATOM 3 C MET A 1 23.136 -0.350 -8.384 1.00 0.00 C ATOM 4 O MET A 1 24.164 0.239 -8.063 1.00 0.00 O ATOM 5 CB MET A 1 21.631 -0.814 -6.426 1.00 0.00 C ATOM 6 CG MET A 1 20.436 -0.143 -7.103 1.00 0.00 C ATOM 7 SD MET A 1 18.999 0.132 -6.033 1.00 0.00 S ATOM 8 CE MET A 1 19.699 1.301 -4.841 1.00 0.00 C ATOM 0 H1 MET A 1 23.330 -3.144 -6.603 1.00 0.00 H new ATOM 0 H2 MET A 1 24.478 -2.222 -7.449 1.00 0.00 H new ATOM 0 H3 MET A 1 23.922 -1.701 -5.932 1.00 0.00 H new ATOM 0 HA MET A 1 21.992 -2.124 -8.083 1.00 0.00 H new ATOM 0 HB2 MET A 1 21.281 -1.588 -5.743 1.00 0.00 H new ATOM 0 HB3 MET A 1 22.175 -0.083 -5.828 1.00 0.00 H new ATOM 0 HG2 MET A 1 20.759 0.817 -7.506 1.00 0.00 H new ATOM 0 HG3 MET A 1 20.127 -0.756 -7.950 1.00 0.00 H new ATOM 0 HE1 MET A 1 19.055 1.355 -3.963 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.692 0.965 -4.542 1.00 0.00 H new ATOM 0 HE3 MET A 1 19.772 2.287 -5.299 1.00 0.00 H new ATOM 20 N LEU A 2 22.472 -0.093 -9.515 1.00 0.00 N ATOM 21 CA LEU A 2 22.871 0.944 -10.454 1.00 0.00 C ATOM 22 C LEU A 2 21.856 2.087 -10.388 1.00 0.00 C ATOM 23 O LEU A 2 20.790 2.020 -10.999 1.00 0.00 O ATOM 24 CB LEU A 2 22.956 0.359 -11.871 1.00 0.00 C ATOM 25 CG LEU A 2 23.967 1.066 -12.789 1.00 0.00 C ATOM 26 CD1 LEU A 2 23.494 1.025 -14.233 1.00 0.00 C ATOM 27 CD2 LEU A 2 24.259 2.518 -12.441 1.00 0.00 C ATOM 0 H LEU A 2 21.638 -0.606 -9.801 1.00 0.00 H new ATOM 0 HA LEU A 2 23.856 1.331 -10.192 1.00 0.00 H new ATOM 0 HB2 LEU A 2 23.223 -0.695 -11.800 1.00 0.00 H new ATOM 0 HB3 LEU A 2 21.969 0.408 -12.331 1.00 0.00 H new ATOM 0 HG LEU A 2 24.892 0.509 -12.641 1.00 0.00 H new ATOM 0 HD11 LEU A 2 24.221 1.530 -14.869 1.00 0.00 H new ATOM 0 HD12 LEU A 2 23.391 -0.012 -14.553 1.00 0.00 H new ATOM 0 HD13 LEU A 2 22.530 1.528 -14.315 1.00 0.00 H new ATOM 0 HD21 LEU A 2 24.983 2.923 -13.148 1.00 0.00 H new ATOM 0 HD22 LEU A 2 23.337 3.097 -12.494 1.00 0.00 H new ATOM 0 HD23 LEU A 2 24.666 2.575 -11.432 1.00 0.00 H new ATOM 39 N ILE A 3 22.190 3.141 -9.644 1.00 0.00 N ATOM 40 CA ILE A 3 21.324 4.294 -9.468 1.00 0.00 C ATOM 41 C ILE A 3 21.576 5.284 -10.600 1.00 0.00 C ATOM 42 O ILE A 3 22.699 5.395 -11.086 1.00 0.00 O ATOM 43 CB ILE A 3 21.615 4.948 -8.111 1.00 0.00 C ATOM 44 CG1 ILE A 3 21.255 4.012 -6.950 1.00 0.00 C ATOM 45 CG2 ILE A 3 20.784 6.222 -7.946 1.00 0.00 C ATOM 46 CD1 ILE A 3 22.357 3.010 -6.624 1.00 0.00 C ATOM 0 H ILE A 3 23.077 3.214 -9.145 1.00 0.00 H new ATOM 0 HA ILE A 3 20.279 3.984 -9.491 1.00 0.00 H new ATOM 0 HB ILE A 3 22.681 5.173 -8.089 1.00 0.00 H new ATOM 0 HG12 ILE A 3 21.041 4.609 -6.063 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.342 3.471 -7.198 1.00 0.00 H new ATOM 0 HG21 ILE A 3 21.001 6.675 -6.979 1.00 0.00 H new ATOM 0 HG22 ILE A 3 21.034 6.925 -8.740 1.00 0.00 H new ATOM 0 HG23 ILE A 3 19.724 5.975 -8.001 1.00 0.00 H new ATOM 0 HD11 ILE A 3 22.040 2.378 -5.794 1.00 0.00 H new ATOM 0 HD12 ILE A 3 22.555 2.390 -7.498 1.00 0.00 H new ATOM 0 HD13 ILE A 3 23.265 3.545 -6.346 1.00 0.00 H new ATOM 58 N LEU A 4 20.531 6.003 -11.016 1.00 0.00 N ATOM 59 CA LEU A 4 20.627 7.040 -12.032 1.00 0.00 C ATOM 60 C LEU A 4 19.684 8.184 -11.660 1.00 0.00 C ATOM 61 O LEU A 4 18.810 8.018 -10.810 1.00 0.00 O ATOM 62 CB LEU A 4 20.242 6.461 -13.402 1.00 0.00 C ATOM 63 CG LEU A 4 21.145 5.311 -13.869 1.00 0.00 C ATOM 64 CD1 LEU A 4 20.558 4.696 -15.133 1.00 0.00 C ATOM 65 CD2 LEU A 4 22.551 5.785 -14.223 1.00 0.00 C ATOM 0 H LEU A 4 19.587 5.876 -10.650 1.00 0.00 H new ATOM 0 HA LEU A 4 21.649 7.414 -12.087 1.00 0.00 H new ATOM 0 HB2 LEU A 4 19.212 6.106 -13.359 1.00 0.00 H new ATOM 0 HB3 LEU A 4 20.274 7.259 -14.144 1.00 0.00 H new ATOM 0 HG LEU A 4 21.201 4.598 -13.046 1.00 0.00 H new ATOM 0 HD11 LEU A 4 21.195 3.878 -15.470 1.00 0.00 H new ATOM 0 HD12 LEU A 4 19.559 4.314 -14.922 1.00 0.00 H new ATOM 0 HD13 LEU A 4 20.499 5.455 -15.913 1.00 0.00 H new ATOM 0 HD21 LEU A 4 23.151 4.935 -14.547 1.00 0.00 H new ATOM 0 HD22 LEU A 4 22.496 6.518 -15.028 1.00 0.00 H new ATOM 0 HD23 LEU A 4 23.012 6.241 -13.347 1.00 0.00 H new ATOM 77 N THR A 5 19.854 9.349 -12.295 1.00 0.00 N ATOM 78 CA THR A 5 19.002 10.507 -12.055 1.00 0.00 C ATOM 79 C THR A 5 18.348 10.926 -13.368 1.00 0.00 C ATOM 80 O THR A 5 18.847 11.801 -14.073 1.00 0.00 O ATOM 81 CB THR A 5 19.801 11.647 -11.413 1.00 0.00 C ATOM 82 OG1 THR A 5 20.401 11.194 -10.217 1.00 0.00 O ATOM 83 CG2 THR A 5 18.901 12.827 -11.061 1.00 0.00 C ATOM 0 H THR A 5 20.586 9.510 -12.987 1.00 0.00 H new ATOM 0 HA THR A 5 18.214 10.246 -11.349 1.00 0.00 H new ATOM 0 HB THR A 5 20.553 11.965 -12.135 1.00 0.00 H new ATOM 0 HG1 THR A 5 21.371 11.130 -10.341 1.00 0.00 H new ATOM 0 HG21 THR A 5 19.499 13.618 -10.608 1.00 0.00 H new ATOM 0 HG22 THR A 5 18.426 13.205 -11.966 1.00 0.00 H new ATOM 0 HG23 THR A 5 18.135 12.503 -10.357 1.00 0.00 H new ATOM 91 N ARG A 6 17.219 10.289 -13.693 1.00 0.00 N ATOM 92 CA ARG A 6 16.471 10.554 -14.914 1.00 0.00 C ATOM 93 C ARG A 6 15.663 11.840 -14.785 1.00 0.00 C ATOM 94 O ARG A 6 15.632 12.461 -13.725 1.00 0.00 O ATOM 95 CB ARG A 6 15.524 9.378 -15.188 1.00 0.00 C ATOM 96 CG ARG A 6 16.267 8.098 -15.586 1.00 0.00 C ATOM 97 CD ARG A 6 16.582 8.063 -17.084 1.00 0.00 C ATOM 98 NE ARG A 6 17.411 9.191 -17.514 1.00 0.00 N ATOM 99 CZ ARG A 6 18.701 9.368 -17.218 1.00 0.00 C ATOM 100 NH1 ARG A 6 19.352 8.503 -16.444 1.00 0.00 N ATOM 101 NH2 ARG A 6 19.344 10.425 -17.704 1.00 0.00 N ATOM 0 H ARG A 6 16.799 9.568 -13.106 1.00 0.00 H new ATOM 0 HA ARG A 6 17.173 10.670 -15.739 1.00 0.00 H new ATOM 0 HB2 ARG A 6 14.926 9.184 -14.298 1.00 0.00 H new ATOM 0 HB3 ARG A 6 14.831 9.653 -15.983 1.00 0.00 H new ATOM 0 HG2 ARG A 6 17.195 8.025 -15.018 1.00 0.00 H new ATOM 0 HG3 ARG A 6 15.663 7.230 -15.322 1.00 0.00 H new ATOM 0 HD2 ARG A 6 17.093 7.130 -17.322 1.00 0.00 H new ATOM 0 HD3 ARG A 6 15.649 8.068 -17.647 1.00 0.00 H new ATOM 0 HE ARG A 6 16.964 9.904 -18.090 1.00 0.00 H new ATOM 0 HH11 ARG A 6 18.866 7.690 -16.067 1.00 0.00 H new ATOM 0 HH12 ARG A 6 20.337 8.653 -16.228 1.00 0.00 H new ATOM 0 HH21 ARG A 6 18.852 11.093 -18.298 1.00 0.00 H new ATOM 0 HH22 ARG A 6 20.329 10.568 -17.483 1.00 0.00 H new ATOM 115 N LYS A 7 15.008 12.233 -15.879 1.00 0.00 N ATOM 116 CA LYS A 7 14.074 13.349 -15.904 1.00 0.00 C ATOM 117 C LYS A 7 12.759 12.875 -16.511 1.00 0.00 C ATOM 118 O LYS A 7 12.724 11.862 -17.206 1.00 0.00 O ATOM 119 CB LYS A 7 14.672 14.521 -16.687 1.00 0.00 C ATOM 120 CG LYS A 7 15.832 15.124 -15.894 1.00 0.00 C ATOM 121 CD LYS A 7 16.335 16.434 -16.507 1.00 0.00 C ATOM 122 CE LYS A 7 17.183 16.179 -17.753 1.00 0.00 C ATOM 123 NZ LYS A 7 17.612 17.450 -18.368 1.00 0.00 N ATOM 0 H LYS A 7 15.116 11.775 -16.784 1.00 0.00 H new ATOM 0 HA LYS A 7 13.882 13.703 -14.891 1.00 0.00 H new ATOM 0 HB2 LYS A 7 15.022 14.181 -17.662 1.00 0.00 H new ATOM 0 HB3 LYS A 7 13.909 15.278 -16.869 1.00 0.00 H new ATOM 0 HG2 LYS A 7 15.513 15.305 -14.868 1.00 0.00 H new ATOM 0 HG3 LYS A 7 16.652 14.407 -15.851 1.00 0.00 H new ATOM 0 HD2 LYS A 7 15.485 17.065 -16.767 1.00 0.00 H new ATOM 0 HD3 LYS A 7 16.924 16.980 -15.770 1.00 0.00 H new ATOM 0 HE2 LYS A 7 18.058 15.586 -17.487 1.00 0.00 H new ATOM 0 HE3 LYS A 7 16.610 15.596 -18.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 18.186 17.251 -19.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 16.775 18.003 -18.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 18.178 17.993 -17.685 1.00 0.00 H new ATOM 137 N VAL A 8 11.675 13.607 -16.250 1.00 0.00 N ATOM 138 CA VAL A 8 10.352 13.233 -16.739 1.00 0.00 C ATOM 139 C VAL A 8 10.372 13.053 -18.255 1.00 0.00 C ATOM 140 O VAL A 8 10.811 13.938 -18.988 1.00 0.00 O ATOM 141 CB VAL A 8 9.337 14.301 -16.327 1.00 0.00 C ATOM 142 CG1 VAL A 8 7.958 13.978 -16.903 1.00 0.00 C ATOM 143 CG2 VAL A 8 9.246 14.358 -14.803 1.00 0.00 C ATOM 0 H VAL A 8 11.690 14.466 -15.700 1.00 0.00 H new ATOM 0 HA VAL A 8 10.060 12.281 -16.297 1.00 0.00 H new ATOM 0 HB VAL A 8 9.666 15.265 -16.715 1.00 0.00 H new ATOM 0 HG11 VAL A 8 7.248 14.748 -16.600 1.00 0.00 H new ATOM 0 HG12 VAL A 8 8.017 13.946 -17.991 1.00 0.00 H new ATOM 0 HG13 VAL A 8 7.625 13.010 -16.529 1.00 0.00 H new ATOM 0 HG21 VAL A 8 8.523 15.119 -14.510 1.00 0.00 H new ATOM 0 HG22 VAL A 8 8.927 13.388 -14.421 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.223 14.608 -14.389 1.00 0.00 H new ATOM 153 N GLY A 9 9.888 11.895 -18.714 1.00 0.00 N ATOM 154 CA GLY A 9 9.790 11.565 -20.128 1.00 0.00 C ATOM 155 C GLY A 9 10.950 10.697 -20.616 1.00 0.00 C ATOM 156 O GLY A 9 10.915 10.220 -21.749 1.00 0.00 O ATOM 0 H GLY A 9 9.550 11.154 -18.100 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.850 11.044 -20.310 1.00 0.00 H new ATOM 0 HA3 GLY A 9 9.762 12.486 -20.710 1.00 0.00 H new ATOM 160 N GLU A 10 11.976 10.486 -19.784 1.00 0.00 N ATOM 161 CA GLU A 10 13.112 9.648 -20.147 1.00 0.00 C ATOM 162 C GLU A 10 12.846 8.185 -19.784 1.00 0.00 C ATOM 163 O GLU A 10 11.812 7.860 -19.194 1.00 0.00 O ATOM 164 CB GLU A 10 14.381 10.162 -19.464 1.00 0.00 C ATOM 165 CG GLU A 10 14.687 11.590 -19.925 1.00 0.00 C ATOM 166 CD GLU A 10 16.024 12.087 -19.380 1.00 0.00 C ATOM 167 OE1 GLU A 10 16.436 11.596 -18.305 1.00 0.00 O ATOM 168 OE2 GLU A 10 16.630 12.958 -20.043 1.00 0.00 O ATOM 0 H GLU A 10 12.038 10.890 -18.849 1.00 0.00 H new ATOM 0 HA GLU A 10 13.255 9.700 -21.226 1.00 0.00 H new ATOM 0 HB2 GLU A 10 14.255 10.141 -18.382 1.00 0.00 H new ATOM 0 HB3 GLU A 10 15.220 9.508 -19.700 1.00 0.00 H new ATOM 0 HG2 GLU A 10 14.703 11.625 -21.014 1.00 0.00 H new ATOM 0 HG3 GLU A 10 13.890 12.257 -19.596 1.00 0.00 H new ATOM 175 N SER A 11 13.779 7.295 -20.138 1.00 0.00 N ATOM 176 CA SER A 11 13.611 5.863 -19.935 1.00 0.00 C ATOM 177 C SER A 11 14.893 5.187 -19.456 1.00 0.00 C ATOM 178 O SER A 11 15.959 5.799 -19.413 1.00 0.00 O ATOM 179 CB SER A 11 13.159 5.220 -21.249 1.00 0.00 C ATOM 180 OG SER A 11 11.988 5.842 -21.734 1.00 0.00 O ATOM 0 H SER A 11 14.666 7.551 -20.571 1.00 0.00 H new ATOM 0 HA SER A 11 12.860 5.726 -19.157 1.00 0.00 H new ATOM 0 HB2 SER A 11 13.953 5.301 -21.991 1.00 0.00 H new ATOM 0 HB3 SER A 11 12.974 4.157 -21.094 1.00 0.00 H new ATOM 0 HG SER A 11 11.716 5.418 -22.575 1.00 0.00 H new ATOM 186 N ILE A 12 14.763 3.906 -19.098 1.00 0.00 N ATOM 187 CA ILE A 12 15.838 3.016 -18.677 1.00 0.00 C ATOM 188 C ILE A 12 15.602 1.667 -19.358 1.00 0.00 C ATOM 189 O ILE A 12 14.493 1.398 -19.818 1.00 0.00 O ATOM 190 CB ILE A 12 15.808 2.871 -17.146 1.00 0.00 C ATOM 191 CG1 ILE A 12 16.131 4.186 -16.426 1.00 0.00 C ATOM 192 CG2 ILE A 12 16.754 1.774 -16.645 1.00 0.00 C ATOM 193 CD1 ILE A 12 17.544 4.673 -16.730 1.00 0.00 C ATOM 0 H ILE A 12 13.855 3.442 -19.096 1.00 0.00 H new ATOM 0 HA ILE A 12 16.816 3.408 -18.957 1.00 0.00 H new ATOM 0 HB ILE A 12 14.784 2.586 -16.905 1.00 0.00 H new ATOM 0 HG12 ILE A 12 15.413 4.949 -16.725 1.00 0.00 H new ATOM 0 HG13 ILE A 12 16.019 4.047 -15.351 1.00 0.00 H new ATOM 0 HG21 ILE A 12 16.696 1.712 -15.558 1.00 0.00 H new ATOM 0 HG22 ILE A 12 16.464 0.817 -17.079 1.00 0.00 H new ATOM 0 HG23 ILE A 12 17.776 2.012 -16.941 1.00 0.00 H new ATOM 0 HD11 ILE A 12 17.729 5.607 -16.199 1.00 0.00 H new ATOM 0 HD12 ILE A 12 18.265 3.922 -16.406 1.00 0.00 H new ATOM 0 HD13 ILE A 12 17.649 4.838 -17.802 1.00 0.00 H new ATOM 205 N ASN A 13 16.625 0.812 -19.429 1.00 0.00 N ATOM 206 CA ASN A 13 16.472 -0.498 -20.037 1.00 0.00 C ATOM 207 C ASN A 13 17.188 -1.564 -19.212 1.00 0.00 C ATOM 208 O ASN A 13 18.160 -1.263 -18.519 1.00 0.00 O ATOM 209 CB ASN A 13 17.013 -0.435 -21.466 1.00 0.00 C ATOM 210 CG ASN A 13 16.521 -1.617 -22.284 1.00 0.00 C ATOM 211 OD1 ASN A 13 17.279 -2.531 -22.595 1.00 0.00 O ATOM 212 ND2 ASN A 13 15.239 -1.593 -22.634 1.00 0.00 N ATOM 0 H ASN A 13 17.561 1.008 -19.073 1.00 0.00 H new ATOM 0 HA ASN A 13 15.418 -0.776 -20.065 1.00 0.00 H new ATOM 0 HB2 ASN A 13 16.698 0.496 -21.938 1.00 0.00 H new ATOM 0 HB3 ASN A 13 18.103 -0.429 -21.447 1.00 0.00 H new ATOM 0 HD21 ASN A 13 14.846 -2.356 -23.185 1.00 0.00 H new ATOM 0 HD22 ASN A 13 14.648 -0.811 -22.352 1.00 0.00 H new ATOM 219 N ILE A 14 16.708 -2.809 -19.288 1.00 0.00 N ATOM 220 CA ILE A 14 17.276 -3.935 -18.557 1.00 0.00 C ATOM 221 C ILE A 14 17.235 -5.179 -19.444 1.00 0.00 C ATOM 222 O ILE A 14 16.419 -5.266 -20.363 1.00 0.00 O ATOM 223 CB ILE A 14 16.493 -4.179 -17.251 1.00 0.00 C ATOM 224 CG1 ILE A 14 16.251 -2.862 -16.495 1.00 0.00 C ATOM 225 CG2 ILE A 14 17.260 -5.155 -16.352 1.00 0.00 C ATOM 226 CD1 ILE A 14 15.398 -3.061 -15.241 1.00 0.00 C ATOM 0 H ILE A 14 15.906 -3.061 -19.866 1.00 0.00 H new ATOM 0 HA ILE A 14 18.310 -3.712 -18.294 1.00 0.00 H new ATOM 0 HB ILE A 14 15.526 -4.608 -17.514 1.00 0.00 H new ATOM 0 HG12 ILE A 14 17.209 -2.425 -16.214 1.00 0.00 H new ATOM 0 HG13 ILE A 14 15.758 -2.150 -17.158 1.00 0.00 H new ATOM 0 HG21 ILE A 14 16.699 -5.321 -15.432 1.00 0.00 H new ATOM 0 HG22 ILE A 14 17.391 -6.103 -16.873 1.00 0.00 H new ATOM 0 HG23 ILE A 14 18.237 -4.736 -16.110 1.00 0.00 H new ATOM 0 HD11 ILE A 14 15.255 -2.102 -14.742 1.00 0.00 H new ATOM 0 HD12 ILE A 14 14.428 -3.472 -15.522 1.00 0.00 H new ATOM 0 HD13 ILE A 14 15.902 -3.751 -14.564 1.00 0.00 H new ATOM 238 N GLY A 15 18.119 -6.142 -19.165 1.00 0.00 N ATOM 239 CA GLY A 15 18.173 -7.411 -19.878 1.00 0.00 C ATOM 240 C GLY A 15 16.822 -8.121 -19.864 1.00 0.00 C ATOM 241 O GLY A 15 15.883 -7.671 -19.211 1.00 0.00 O ATOM 0 H GLY A 15 18.821 -6.057 -18.430 1.00 0.00 H new ATOM 0 HA2 GLY A 15 18.483 -7.237 -20.909 1.00 0.00 H new ATOM 0 HA3 GLY A 15 18.927 -8.053 -19.423 1.00 0.00 H new ATOM 245 N ASP A 16 16.726 -9.239 -20.590 1.00 0.00 N ATOM 246 CA ASP A 16 15.466 -9.941 -20.804 1.00 0.00 C ATOM 247 C ASP A 16 14.422 -9.026 -21.458 1.00 0.00 C ATOM 248 O ASP A 16 13.227 -9.319 -21.415 1.00 0.00 O ATOM 249 CB ASP A 16 14.974 -10.587 -19.504 1.00 0.00 C ATOM 250 CG ASP A 16 15.985 -11.598 -18.971 1.00 0.00 C ATOM 251 OD1 ASP A 16 16.191 -12.623 -19.661 1.00 0.00 O ATOM 252 OD2 ASP A 16 16.544 -11.342 -17.882 1.00 0.00 O ATOM 0 H ASP A 16 17.525 -9.680 -21.045 1.00 0.00 H new ATOM 0 HA ASP A 16 15.636 -10.755 -21.509 1.00 0.00 H new ATOM 0 HB2 ASP A 16 14.799 -9.815 -18.755 1.00 0.00 H new ATOM 0 HB3 ASP A 16 14.019 -11.082 -19.680 1.00 0.00 H new ATOM 257 N ASP A 17 14.884 -7.921 -22.061 1.00 0.00 N ATOM 258 CA ASP A 17 14.094 -6.979 -22.846 1.00 0.00 C ATOM 259 C ASP A 17 13.190 -6.067 -22.014 1.00 0.00 C ATOM 260 O ASP A 17 12.248 -5.491 -22.561 1.00 0.00 O ATOM 261 CB ASP A 17 13.301 -7.713 -23.934 1.00 0.00 C ATOM 262 CG ASP A 17 14.218 -8.530 -24.839 1.00 0.00 C ATOM 263 OD1 ASP A 17 15.029 -7.902 -25.557 1.00 0.00 O ATOM 264 OD2 ASP A 17 14.104 -9.776 -24.811 1.00 0.00 O ATOM 0 H ASP A 17 15.867 -7.653 -22.008 1.00 0.00 H new ATOM 0 HA ASP A 17 14.812 -6.309 -23.318 1.00 0.00 H new ATOM 0 HB2 ASP A 17 12.567 -8.371 -23.469 1.00 0.00 H new ATOM 0 HB3 ASP A 17 12.747 -6.990 -24.533 1.00 0.00 H new ATOM 269 N ILE A 18 13.440 -5.915 -20.709 1.00 0.00 N ATOM 270 CA ILE A 18 12.575 -5.054 -19.907 1.00 0.00 C ATOM 271 C ILE A 18 12.950 -3.596 -20.167 1.00 0.00 C ATOM 272 O ILE A 18 14.116 -3.278 -20.393 1.00 0.00 O ATOM 273 CB ILE A 18 12.680 -5.384 -18.409 1.00 0.00 C ATOM 274 CG1 ILE A 18 12.027 -6.732 -18.089 1.00 0.00 C ATOM 275 CG2 ILE A 18 11.964 -4.324 -17.565 1.00 0.00 C ATOM 276 CD1 ILE A 18 13.044 -7.861 -18.187 1.00 0.00 C ATOM 0 H ILE A 18 14.206 -6.360 -20.203 1.00 0.00 H new ATOM 0 HA ILE A 18 11.539 -5.226 -20.199 1.00 0.00 H new ATOM 0 HB ILE A 18 13.743 -5.413 -18.172 1.00 0.00 H new ATOM 0 HG12 ILE A 18 11.601 -6.706 -17.086 1.00 0.00 H new ATOM 0 HG13 ILE A 18 11.204 -6.916 -18.780 1.00 0.00 H new ATOM 0 HG21 ILE A 18 12.052 -4.579 -16.509 1.00 0.00 H new ATOM 0 HG22 ILE A 18 12.419 -3.350 -17.742 1.00 0.00 H new ATOM 0 HG23 ILE A 18 10.911 -4.288 -17.843 1.00 0.00 H new ATOM 0 HD11 ILE A 18 12.559 -8.809 -17.956 1.00 0.00 H new ATOM 0 HD12 ILE A 18 13.450 -7.898 -19.198 1.00 0.00 H new ATOM 0 HD13 ILE A 18 13.853 -7.685 -17.478 1.00 0.00 H new ATOM 288 N THR A 19 11.956 -2.705 -20.134 1.00 0.00 N ATOM 289 CA THR A 19 12.166 -1.276 -20.305 1.00 0.00 C ATOM 290 C THR A 19 11.390 -0.542 -19.222 1.00 0.00 C ATOM 291 O THR A 19 10.265 -0.922 -18.906 1.00 0.00 O ATOM 292 CB THR A 19 11.699 -0.843 -21.699 1.00 0.00 C ATOM 293 OG1 THR A 19 12.310 -1.642 -22.688 1.00 0.00 O ATOM 294 CG2 THR A 19 12.066 0.614 -21.971 1.00 0.00 C ATOM 0 H THR A 19 10.980 -2.962 -19.987 1.00 0.00 H new ATOM 0 HA THR A 19 13.226 -1.036 -20.217 1.00 0.00 H new ATOM 0 HB THR A 19 10.616 -0.960 -21.733 1.00 0.00 H new ATOM 0 HG1 THR A 19 12.003 -1.357 -23.574 1.00 0.00 H new ATOM 0 HG21 THR A 19 11.723 0.896 -22.967 1.00 0.00 H new ATOM 0 HG22 THR A 19 11.589 1.254 -21.229 1.00 0.00 H new ATOM 0 HG23 THR A 19 13.148 0.734 -21.912 1.00 0.00 H new ATOM 302 N ILE A 20 11.984 0.509 -18.654 1.00 0.00 N ATOM 303 CA ILE A 20 11.358 1.276 -17.583 1.00 0.00 C ATOM 304 C ILE A 20 11.242 2.729 -18.039 1.00 0.00 C ATOM 305 O ILE A 20 12.008 3.173 -18.894 1.00 0.00 O ATOM 306 CB ILE A 20 12.187 1.154 -16.293 1.00 0.00 C ATOM 307 CG1 ILE A 20 12.623 -0.288 -15.987 1.00 0.00 C ATOM 308 CG2 ILE A 20 11.431 1.726 -15.090 1.00 0.00 C ATOM 309 CD1 ILE A 20 11.450 -1.234 -15.720 1.00 0.00 C ATOM 0 H ILE A 20 12.907 0.849 -18.924 1.00 0.00 H new ATOM 0 HA ILE A 20 10.362 0.890 -17.366 1.00 0.00 H new ATOM 0 HB ILE A 20 13.090 1.739 -16.469 1.00 0.00 H new ATOM 0 HG12 ILE A 20 13.204 -0.670 -16.826 1.00 0.00 H new ATOM 0 HG13 ILE A 20 13.282 -0.284 -15.119 1.00 0.00 H new ATOM 0 HG21 ILE A 20 12.043 1.625 -14.194 1.00 0.00 H new ATOM 0 HG22 ILE A 20 11.214 2.780 -15.264 1.00 0.00 H new ATOM 0 HG23 ILE A 20 10.497 1.181 -14.955 1.00 0.00 H new ATOM 0 HD11 ILE A 20 11.829 -2.234 -15.511 1.00 0.00 H new ATOM 0 HD12 ILE A 20 10.881 -0.875 -14.862 1.00 0.00 H new ATOM 0 HD13 ILE A 20 10.803 -1.267 -16.596 1.00 0.00 H new ATOM 321 N THR A 21 10.291 3.480 -17.478 1.00 0.00 N ATOM 322 CA THR A 21 10.068 4.863 -17.879 1.00 0.00 C ATOM 323 C THR A 21 9.647 5.700 -16.674 1.00 0.00 C ATOM 324 O THR A 21 9.197 5.159 -15.667 1.00 0.00 O ATOM 325 CB THR A 21 8.977 4.894 -18.962 1.00 0.00 C ATOM 326 OG1 THR A 21 9.254 3.929 -19.955 1.00 0.00 O ATOM 327 CG2 THR A 21 8.890 6.253 -19.656 1.00 0.00 C ATOM 0 H THR A 21 9.665 3.149 -16.744 1.00 0.00 H new ATOM 0 HA THR A 21 10.990 5.285 -18.278 1.00 0.00 H new ATOM 0 HB THR A 21 8.033 4.688 -18.458 1.00 0.00 H new ATOM 0 HG1 THR A 21 8.554 3.954 -20.640 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.106 6.226 -20.412 1.00 0.00 H new ATOM 0 HG22 THR A 21 8.658 7.023 -18.920 1.00 0.00 H new ATOM 0 HG23 THR A 21 9.844 6.481 -20.131 1.00 0.00 H new ATOM 335 N ILE A 22 9.792 7.024 -16.778 1.00 0.00 N ATOM 336 CA ILE A 22 9.335 7.967 -15.766 1.00 0.00 C ATOM 337 C ILE A 22 8.290 8.870 -16.417 1.00 0.00 C ATOM 338 O ILE A 22 8.622 9.824 -17.116 1.00 0.00 O ATOM 339 CB ILE A 22 10.530 8.711 -15.143 1.00 0.00 C ATOM 340 CG1 ILE A 22 10.086 9.902 -14.286 1.00 0.00 C ATOM 341 CG2 ILE A 22 11.517 9.213 -16.199 1.00 0.00 C ATOM 342 CD1 ILE A 22 9.215 9.451 -13.117 1.00 0.00 C ATOM 0 H ILE A 22 10.236 7.472 -17.579 1.00 0.00 H new ATOM 0 HA ILE A 22 8.858 7.465 -14.924 1.00 0.00 H new ATOM 0 HB ILE A 22 11.027 7.976 -14.510 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.963 10.427 -13.907 1.00 0.00 H new ATOM 0 HG13 ILE A 22 9.532 10.610 -14.903 1.00 0.00 H new ATOM 0 HG21 ILE A 22 12.342 9.731 -15.709 1.00 0.00 H new ATOM 0 HG22 ILE A 22 11.905 8.367 -16.766 1.00 0.00 H new ATOM 0 HG23 ILE A 22 11.008 9.900 -16.875 1.00 0.00 H new ATOM 0 HD11 ILE A 22 8.917 10.319 -12.529 1.00 0.00 H new ATOM 0 HD12 ILE A 22 8.326 8.948 -13.498 1.00 0.00 H new ATOM 0 HD13 ILE A 22 9.779 8.763 -12.487 1.00 0.00 H new ATOM 354 N LEU A 23 7.010 8.563 -16.181 1.00 0.00 N ATOM 355 CA LEU A 23 5.912 9.234 -16.857 1.00 0.00 C ATOM 356 C LEU A 23 5.691 10.612 -16.245 1.00 0.00 C ATOM 357 O LEU A 23 5.140 11.496 -16.899 1.00 0.00 O ATOM 358 CB LEU A 23 4.639 8.388 -16.757 1.00 0.00 C ATOM 359 CG LEU A 23 4.876 6.907 -17.082 1.00 0.00 C ATOM 360 CD1 LEU A 23 3.537 6.180 -17.106 1.00 0.00 C ATOM 361 CD2 LEU A 23 5.543 6.714 -18.442 1.00 0.00 C ATOM 0 H LEU A 23 6.715 7.846 -15.519 1.00 0.00 H new ATOM 0 HA LEU A 23 6.162 9.358 -17.911 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.231 8.472 -15.750 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.889 8.788 -17.439 1.00 0.00 H new ATOM 0 HG LEU A 23 5.536 6.507 -16.313 1.00 0.00 H new ATOM 0 HD11 LEU A 23 3.699 5.127 -17.336 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.057 6.269 -16.131 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.896 6.624 -17.868 1.00 0.00 H new ATOM 0 HD21 LEU A 23 5.690 5.650 -18.627 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.908 7.134 -19.222 1.00 0.00 H new ATOM 0 HD23 LEU A 23 6.508 7.220 -18.449 1.00 0.00 H new ATOM 373 N GLY A 24 6.119 10.796 -14.991 1.00 0.00 N ATOM 374 CA GLY A 24 6.128 12.117 -14.382 1.00 0.00 C ATOM 375 C GLY A 24 6.027 12.073 -12.864 1.00 0.00 C ATOM 376 O GLY A 24 5.745 11.031 -12.275 1.00 0.00 O ATOM 0 H GLY A 24 6.460 10.048 -14.387 1.00 0.00 H new ATOM 0 HA2 GLY A 24 7.044 12.635 -14.665 1.00 0.00 H new ATOM 0 HA3 GLY A 24 5.297 12.700 -14.779 1.00 0.00 H new ATOM 380 N VAL A 25 6.261 13.225 -12.231 1.00 0.00 N ATOM 381 CA VAL A 25 6.146 13.358 -10.786 1.00 0.00 C ATOM 382 C VAL A 25 4.677 13.501 -10.396 1.00 0.00 C ATOM 383 O VAL A 25 3.825 13.780 -11.239 1.00 0.00 O ATOM 384 CB VAL A 25 6.956 14.564 -10.297 1.00 0.00 C ATOM 385 CG1 VAL A 25 8.438 14.366 -10.618 1.00 0.00 C ATOM 386 CG2 VAL A 25 6.476 15.866 -10.941 1.00 0.00 C ATOM 0 H VAL A 25 6.534 14.085 -12.707 1.00 0.00 H new ATOM 0 HA VAL A 25 6.548 12.463 -10.312 1.00 0.00 H new ATOM 0 HB VAL A 25 6.812 14.638 -9.219 1.00 0.00 H new ATOM 0 HG11 VAL A 25 9.005 15.228 -10.267 1.00 0.00 H new ATOM 0 HG12 VAL A 25 8.801 13.466 -10.121 1.00 0.00 H new ATOM 0 HG13 VAL A 25 8.566 14.262 -11.695 1.00 0.00 H new ATOM 0 HG21 VAL A 25 7.074 16.698 -10.569 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.583 15.797 -12.024 1.00 0.00 H new ATOM 0 HG23 VAL A 25 5.428 16.032 -10.689 1.00 0.00 H new ATOM 396 N SER A 26 4.388 13.308 -9.109 1.00 0.00 N ATOM 397 CA SER A 26 3.050 13.413 -8.542 1.00 0.00 C ATOM 398 C SER A 26 3.166 13.829 -7.076 1.00 0.00 C ATOM 399 O SER A 26 2.505 13.263 -6.206 1.00 0.00 O ATOM 400 CB SER A 26 2.324 12.074 -8.685 1.00 0.00 C ATOM 401 OG SER A 26 2.002 11.833 -10.039 1.00 0.00 O ATOM 0 H SER A 26 5.098 13.068 -8.417 1.00 0.00 H new ATOM 0 HA SER A 26 2.470 14.167 -9.074 1.00 0.00 H new ATOM 0 HB2 SER A 26 2.953 11.269 -8.305 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.415 12.079 -8.083 1.00 0.00 H new ATOM 0 HG SER A 26 2.426 12.514 -10.602 1.00 0.00 H new ATOM 407 N GLY A 27 4.015 14.825 -6.806 1.00 0.00 N ATOM 408 CA GLY A 27 4.280 15.297 -5.457 1.00 0.00 C ATOM 409 C GLY A 27 5.214 14.326 -4.749 1.00 0.00 C ATOM 410 O GLY A 27 6.307 14.050 -5.241 1.00 0.00 O ATOM 0 H GLY A 27 4.537 15.325 -7.526 1.00 0.00 H new ATOM 0 HA2 GLY A 27 4.729 16.290 -5.490 1.00 0.00 H new ATOM 0 HA3 GLY A 27 3.346 15.388 -4.903 1.00 0.00 H new ATOM 414 N GLN A 28 4.786 13.806 -3.596 1.00 0.00 N ATOM 415 CA GLN A 28 5.550 12.794 -2.882 1.00 0.00 C ATOM 416 C GLN A 28 5.488 11.461 -3.635 1.00 0.00 C ATOM 417 O GLN A 28 6.177 10.504 -3.280 1.00 0.00 O ATOM 418 CB GLN A 28 4.984 12.663 -1.465 1.00 0.00 C ATOM 419 CG GLN A 28 5.952 11.951 -0.514 1.00 0.00 C ATOM 420 CD GLN A 28 7.253 12.730 -0.348 1.00 0.00 C ATOM 421 OE1 GLN A 28 8.328 12.231 -0.670 1.00 0.00 O ATOM 422 NE2 GLN A 28 7.169 13.959 0.155 1.00 0.00 N ATOM 0 H GLN A 28 3.913 14.073 -3.141 1.00 0.00 H new ATOM 0 HA GLN A 28 6.598 13.086 -2.818 1.00 0.00 H new ATOM 0 HB2 GLN A 28 4.758 13.655 -1.074 1.00 0.00 H new ATOM 0 HB3 GLN A 28 4.044 12.113 -1.501 1.00 0.00 H new ATOM 0 HG2 GLN A 28 5.478 11.822 0.459 1.00 0.00 H new ATOM 0 HG3 GLN A 28 6.171 10.954 -0.896 1.00 0.00 H new ATOM 0 HE21 GLN A 28 6.260 14.344 0.412 1.00 0.00 H new ATOM 0 HE22 GLN A 28 8.014 14.516 0.283 1.00 0.00 H new ATOM 431 N GLN A 29 4.656 11.397 -4.682 1.00 0.00 N ATOM 432 CA GLN A 29 4.497 10.209 -5.502 1.00 0.00 C ATOM 433 C GLN A 29 5.190 10.406 -6.851 1.00 0.00 C ATOM 434 O GLN A 29 5.558 11.526 -7.206 1.00 0.00 O ATOM 435 CB GLN A 29 3.011 9.906 -5.696 1.00 0.00 C ATOM 436 CG GLN A 29 2.211 10.013 -4.395 1.00 0.00 C ATOM 437 CD GLN A 29 0.760 9.617 -4.615 1.00 0.00 C ATOM 438 OE1 GLN A 29 0.237 8.735 -3.940 1.00 0.00 O ATOM 439 NE2 GLN A 29 0.092 10.263 -5.560 1.00 0.00 N ATOM 0 H GLN A 29 4.073 12.180 -4.979 1.00 0.00 H new ATOM 0 HA GLN A 29 4.961 9.361 -4.999 1.00 0.00 H new ATOM 0 HB2 GLN A 29 2.597 10.597 -6.430 1.00 0.00 H new ATOM 0 HB3 GLN A 29 2.900 8.902 -6.105 1.00 0.00 H new ATOM 0 HG2 GLN A 29 2.656 9.370 -3.636 1.00 0.00 H new ATOM 0 HG3 GLN A 29 2.260 11.034 -4.016 1.00 0.00 H new ATOM 0 HE21 GLN A 29 0.554 10.991 -6.104 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -0.884 10.032 -5.743 1.00 0.00 H new ATOM 448 N VAL A 30 5.370 9.318 -7.607 1.00 0.00 N ATOM 449 CA VAL A 30 6.072 9.330 -8.883 1.00 0.00 C ATOM 450 C VAL A 30 5.483 8.276 -9.822 1.00 0.00 C ATOM 451 O VAL A 30 5.503 7.088 -9.502 1.00 0.00 O ATOM 452 CB VAL A 30 7.560 9.031 -8.647 1.00 0.00 C ATOM 453 CG1 VAL A 30 8.330 9.119 -9.961 1.00 0.00 C ATOM 454 CG2 VAL A 30 8.202 10.020 -7.671 1.00 0.00 C ATOM 0 H VAL A 30 5.026 8.395 -7.342 1.00 0.00 H new ATOM 0 HA VAL A 30 5.960 10.313 -9.341 1.00 0.00 H new ATOM 0 HB VAL A 30 7.610 8.027 -8.225 1.00 0.00 H new ATOM 0 HG11 VAL A 30 9.383 8.905 -9.780 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.928 8.393 -10.668 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.229 10.122 -10.375 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.254 9.767 -7.536 1.00 0.00 H new ATOM 0 HG22 VAL A 30 8.120 11.031 -8.071 1.00 0.00 H new ATOM 0 HG23 VAL A 30 7.690 9.967 -6.710 1.00 0.00 H new ATOM 464 N ARG A 31 4.957 8.695 -10.979 1.00 0.00 N ATOM 465 CA ARG A 31 4.471 7.760 -11.988 1.00 0.00 C ATOM 466 C ARG A 31 5.638 7.144 -12.739 1.00 0.00 C ATOM 467 O ARG A 31 6.184 7.762 -13.656 1.00 0.00 O ATOM 468 CB ARG A 31 3.550 8.434 -13.003 1.00 0.00 C ATOM 469 CG ARG A 31 2.198 8.770 -12.389 1.00 0.00 C ATOM 470 CD ARG A 31 1.223 9.133 -13.506 1.00 0.00 C ATOM 471 NE ARG A 31 -0.022 9.650 -12.927 1.00 0.00 N ATOM 472 CZ ARG A 31 -1.241 9.577 -13.471 1.00 0.00 C ATOM 473 NH1 ARG A 31 -1.450 8.997 -14.648 1.00 0.00 N ATOM 474 NH2 ARG A 31 -2.281 10.096 -12.820 1.00 0.00 N ATOM 0 H ARG A 31 4.859 9.677 -11.235 1.00 0.00 H new ATOM 0 HA ARG A 31 3.906 6.993 -11.458 1.00 0.00 H new ATOM 0 HB2 ARG A 31 4.019 9.345 -13.374 1.00 0.00 H new ATOM 0 HB3 ARG A 31 3.408 7.777 -13.861 1.00 0.00 H new ATOM 0 HG2 ARG A 31 1.820 7.920 -11.821 1.00 0.00 H new ATOM 0 HG3 ARG A 31 2.297 9.601 -11.691 1.00 0.00 H new ATOM 0 HD2 ARG A 31 1.668 9.881 -14.162 1.00 0.00 H new ATOM 0 HD3 ARG A 31 1.014 8.256 -14.119 1.00 0.00 H new ATOM 0 HE ARG A 31 0.050 10.111 -12.020 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -0.668 8.592 -15.163 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -2.392 8.957 -15.037 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -2.144 10.544 -11.914 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -3.215 10.045 -13.227 1.00 0.00 H new ATOM 488 N ILE A 32 6.004 5.928 -12.338 1.00 0.00 N ATOM 489 CA ILE A 32 6.990 5.118 -13.034 1.00 0.00 C ATOM 490 C ILE A 32 6.225 4.106 -13.885 1.00 0.00 C ATOM 491 O ILE A 32 5.131 3.685 -13.513 1.00 0.00 O ATOM 492 CB ILE A 32 7.894 4.424 -12.003 1.00 0.00 C ATOM 493 CG1 ILE A 32 8.613 5.489 -11.163 1.00 0.00 C ATOM 494 CG2 ILE A 32 8.918 3.522 -12.700 1.00 0.00 C ATOM 495 CD1 ILE A 32 9.465 4.872 -10.051 1.00 0.00 C ATOM 0 H ILE A 32 5.617 5.476 -11.510 1.00 0.00 H new ATOM 0 HA ILE A 32 7.631 5.722 -13.677 1.00 0.00 H new ATOM 0 HB ILE A 32 7.279 3.800 -11.354 1.00 0.00 H new ATOM 0 HG12 ILE A 32 9.248 6.093 -11.812 1.00 0.00 H new ATOM 0 HG13 ILE A 32 7.876 6.161 -10.723 1.00 0.00 H new ATOM 0 HG21 ILE A 32 9.548 3.041 -11.952 1.00 0.00 H new ATOM 0 HG22 ILE A 32 8.397 2.760 -13.280 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.539 4.123 -13.365 1.00 0.00 H new ATOM 0 HD11 ILE A 32 9.954 5.665 -9.485 1.00 0.00 H new ATOM 0 HD12 ILE A 32 8.828 4.290 -9.385 1.00 0.00 H new ATOM 0 HD13 ILE A 32 10.221 4.221 -10.490 1.00 0.00 H new ATOM 507 N GLY A 33 6.793 3.714 -15.025 1.00 0.00 N ATOM 508 CA GLY A 33 6.188 2.719 -15.894 1.00 0.00 C ATOM 509 C GLY A 33 7.147 1.550 -16.066 1.00 0.00 C ATOM 510 O GLY A 33 8.360 1.743 -16.105 1.00 0.00 O ATOM 0 H GLY A 33 7.682 4.079 -15.367 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.247 2.372 -15.468 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.956 3.159 -16.864 1.00 0.00 H new ATOM 514 N ILE A 34 6.601 0.336 -16.169 1.00 0.00 N ATOM 515 CA ILE A 34 7.389 -0.887 -16.242 1.00 0.00 C ATOM 516 C ILE A 34 6.907 -1.730 -17.416 1.00 0.00 C ATOM 517 O ILE A 34 5.796 -2.257 -17.388 1.00 0.00 O ATOM 518 CB ILE A 34 7.253 -1.658 -14.927 1.00 0.00 C ATOM 519 CG1 ILE A 34 7.637 -0.764 -13.742 1.00 0.00 C ATOM 520 CG2 ILE A 34 8.158 -2.893 -14.985 1.00 0.00 C ATOM 521 CD1 ILE A 34 7.196 -1.397 -12.424 1.00 0.00 C ATOM 0 H ILE A 34 5.594 0.178 -16.204 1.00 0.00 H new ATOM 0 HA ILE A 34 8.441 -0.645 -16.396 1.00 0.00 H new ATOM 0 HB ILE A 34 6.218 -1.971 -14.789 1.00 0.00 H new ATOM 0 HG12 ILE A 34 8.716 -0.607 -13.733 1.00 0.00 H new ATOM 0 HG13 ILE A 34 7.173 0.216 -13.854 1.00 0.00 H new ATOM 0 HG21 ILE A 34 8.071 -3.452 -14.053 1.00 0.00 H new ATOM 0 HG22 ILE A 34 7.855 -3.527 -15.818 1.00 0.00 H new ATOM 0 HG23 ILE A 34 9.193 -2.580 -15.125 1.00 0.00 H new ATOM 0 HD11 ILE A 34 7.478 -0.747 -11.596 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.114 -1.531 -12.429 1.00 0.00 H new ATOM 0 HD13 ILE A 34 7.681 -2.366 -12.306 1.00 0.00 H new ATOM 533 N ASN A 35 7.737 -1.864 -18.449 1.00 0.00 N ATOM 534 CA ASN A 35 7.383 -2.609 -19.643 1.00 0.00 C ATOM 535 C ASN A 35 8.189 -3.897 -19.730 1.00 0.00 C ATOM 536 O ASN A 35 9.386 -3.884 -20.012 1.00 0.00 O ATOM 537 CB ASN A 35 7.587 -1.737 -20.875 1.00 0.00 C ATOM 538 CG ASN A 35 6.974 -2.385 -22.107 1.00 0.00 C ATOM 539 OD1 ASN A 35 5.760 -2.546 -22.185 1.00 0.00 O ATOM 540 ND2 ASN A 35 7.806 -2.760 -23.075 1.00 0.00 N ATOM 0 H ASN A 35 8.672 -1.457 -18.476 1.00 0.00 H new ATOM 0 HA ASN A 35 6.330 -2.887 -19.593 1.00 0.00 H new ATOM 0 HB2 ASN A 35 7.136 -0.758 -20.711 1.00 0.00 H new ATOM 0 HB3 ASN A 35 8.652 -1.574 -21.037 1.00 0.00 H new ATOM 0 HD21 ASN A 35 7.440 -3.199 -23.920 1.00 0.00 H new ATOM 0 HD22 ASN A 35 8.809 -2.609 -22.972 1.00 0.00 H new ATOM 547 N ALA A 36 7.504 -5.009 -19.483 1.00 0.00 N ATOM 548 CA ALA A 36 8.071 -6.347 -19.514 1.00 0.00 C ATOM 549 C ALA A 36 7.063 -7.286 -20.175 1.00 0.00 C ATOM 550 O ALA A 36 5.862 -7.018 -20.139 1.00 0.00 O ATOM 551 CB ALA A 36 8.369 -6.779 -18.079 1.00 0.00 C ATOM 0 H ALA A 36 6.511 -5.001 -19.249 1.00 0.00 H new ATOM 0 HA ALA A 36 8.998 -6.372 -20.087 1.00 0.00 H new ATOM 0 HB1 ALA A 36 8.796 -7.782 -18.082 1.00 0.00 H new ATOM 0 HB2 ALA A 36 9.079 -6.084 -17.630 1.00 0.00 H new ATOM 0 HB3 ALA A 36 7.446 -6.779 -17.500 1.00 0.00 H new ATOM 557 N PRO A 37 7.525 -8.387 -20.779 1.00 0.00 N ATOM 558 CA PRO A 37 6.650 -9.369 -21.391 1.00 0.00 C ATOM 559 C PRO A 37 5.944 -10.175 -20.303 1.00 0.00 C ATOM 560 O PRO A 37 6.395 -10.214 -19.161 1.00 0.00 O ATOM 561 CB PRO A 37 7.579 -10.247 -22.229 1.00 0.00 C ATOM 562 CG PRO A 37 8.900 -10.190 -21.463 1.00 0.00 C ATOM 563 CD PRO A 37 8.919 -8.762 -20.920 1.00 0.00 C ATOM 0 HA PRO A 37 5.867 -8.924 -22.004 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.204 -11.267 -22.310 1.00 0.00 H new ATOM 0 HB3 PRO A 37 7.686 -9.866 -23.244 1.00 0.00 H new ATOM 0 HG2 PRO A 37 8.934 -10.928 -20.661 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.753 -10.386 -22.113 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.438 -8.712 -19.963 1.00 0.00 H new ATOM 0 HD3 PRO A 37 9.440 -8.089 -21.601 1.00 0.00 H new ATOM 571 N LYS A 38 4.829 -10.824 -20.650 1.00 0.00 N ATOM 572 CA LYS A 38 4.092 -11.654 -19.704 1.00 0.00 C ATOM 573 C LYS A 38 4.859 -12.936 -19.373 1.00 0.00 C ATOM 574 O LYS A 38 4.389 -13.751 -18.582 1.00 0.00 O ATOM 575 CB LYS A 38 2.697 -11.956 -20.257 1.00 0.00 C ATOM 576 CG LYS A 38 1.781 -10.732 -20.127 1.00 0.00 C ATOM 577 CD LYS A 38 1.369 -10.525 -18.666 1.00 0.00 C ATOM 578 CE LYS A 38 0.443 -9.318 -18.533 1.00 0.00 C ATOM 579 NZ LYS A 38 -0.832 -9.522 -19.246 1.00 0.00 N ATOM 0 H LYS A 38 4.419 -10.788 -21.583 1.00 0.00 H new ATOM 0 HA LYS A 38 3.980 -11.105 -18.769 1.00 0.00 H new ATOM 0 HB2 LYS A 38 2.772 -12.250 -21.304 1.00 0.00 H new ATOM 0 HB3 LYS A 38 2.263 -12.799 -19.720 1.00 0.00 H new ATOM 0 HG2 LYS A 38 2.295 -9.844 -20.496 1.00 0.00 H new ATOM 0 HG3 LYS A 38 0.894 -10.866 -20.746 1.00 0.00 H new ATOM 0 HD2 LYS A 38 0.866 -11.418 -18.295 1.00 0.00 H new ATOM 0 HD3 LYS A 38 2.256 -10.379 -18.050 1.00 0.00 H new ATOM 0 HE2 LYS A 38 0.243 -9.128 -17.478 1.00 0.00 H new ATOM 0 HE3 LYS A 38 0.942 -8.433 -18.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -1.518 -8.801 -18.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -0.674 -9.441 -20.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -1.205 -10.468 -19.027 1.00 0.00 H new ATOM 593 N ASP A 39 6.040 -13.115 -19.972 1.00 0.00 N ATOM 594 CA ASP A 39 6.937 -14.213 -19.646 1.00 0.00 C ATOM 595 C ASP A 39 7.564 -13.993 -18.268 1.00 0.00 C ATOM 596 O ASP A 39 8.199 -14.897 -17.726 1.00 0.00 O ATOM 597 CB ASP A 39 8.035 -14.301 -20.704 1.00 0.00 C ATOM 598 CG ASP A 39 7.473 -14.763 -22.047 1.00 0.00 C ATOM 599 OD1 ASP A 39 7.315 -15.992 -22.214 1.00 0.00 O ATOM 600 OD2 ASP A 39 7.206 -13.883 -22.895 1.00 0.00 O ATOM 0 H ASP A 39 6.397 -12.496 -20.700 1.00 0.00 H new ATOM 0 HA ASP A 39 6.370 -15.144 -19.628 1.00 0.00 H new ATOM 0 HB2 ASP A 39 8.509 -13.327 -20.821 1.00 0.00 H new ATOM 0 HB3 ASP A 39 8.808 -14.994 -20.373 1.00 0.00 H new ATOM 605 N VAL A 40 7.386 -12.794 -17.703 1.00 0.00 N ATOM 606 CA VAL A 40 7.889 -12.436 -16.385 1.00 0.00 C ATOM 607 C VAL A 40 6.815 -11.673 -15.613 1.00 0.00 C ATOM 608 O VAL A 40 5.790 -11.287 -16.177 1.00 0.00 O ATOM 609 CB VAL A 40 9.173 -11.602 -16.508 1.00 0.00 C ATOM 610 CG1 VAL A 40 10.228 -12.327 -17.342 1.00 0.00 C ATOM 611 CG2 VAL A 40 8.911 -10.261 -17.187 1.00 0.00 C ATOM 0 H VAL A 40 6.879 -12.037 -18.162 1.00 0.00 H new ATOM 0 HA VAL A 40 8.132 -13.346 -15.837 1.00 0.00 H new ATOM 0 HB VAL A 40 9.528 -11.447 -15.489 1.00 0.00 H new ATOM 0 HG11 VAL A 40 11.124 -11.711 -17.410 1.00 0.00 H new ATOM 0 HG12 VAL A 40 10.476 -13.277 -16.869 1.00 0.00 H new ATOM 0 HG13 VAL A 40 9.837 -12.511 -18.343 1.00 0.00 H new ATOM 0 HG21 VAL A 40 9.843 -9.700 -17.256 1.00 0.00 H new ATOM 0 HG22 VAL A 40 8.515 -10.431 -18.188 1.00 0.00 H new ATOM 0 HG23 VAL A 40 8.187 -9.693 -16.603 1.00 0.00 H new ATOM 621 N ALA A 41 7.048 -11.452 -14.317 1.00 0.00 N ATOM 622 CA ALA A 41 6.084 -10.772 -13.470 1.00 0.00 C ATOM 623 C ALA A 41 6.652 -9.455 -12.954 1.00 0.00 C ATOM 624 O ALA A 41 7.867 -9.260 -12.924 1.00 0.00 O ATOM 625 CB ALA A 41 5.692 -11.698 -12.320 1.00 0.00 C ATOM 0 H ALA A 41 7.901 -11.738 -13.836 1.00 0.00 H new ATOM 0 HA ALA A 41 5.193 -10.532 -14.050 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.968 -11.195 -11.679 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.250 -12.610 -12.722 1.00 0.00 H new ATOM 0 HB3 ALA A 41 6.578 -11.951 -11.738 1.00 0.00 H new ATOM 631 N VAL A 42 5.756 -8.553 -12.549 1.00 0.00 N ATOM 632 CA VAL A 42 6.108 -7.245 -12.016 1.00 0.00 C ATOM 633 C VAL A 42 5.089 -6.851 -10.953 1.00 0.00 C ATOM 634 O VAL A 42 3.910 -6.660 -11.245 1.00 0.00 O ATOM 635 CB VAL A 42 6.206 -6.209 -13.149 1.00 0.00 C ATOM 636 CG1 VAL A 42 5.157 -6.436 -14.235 1.00 0.00 C ATOM 637 CG2 VAL A 42 6.051 -4.782 -12.623 1.00 0.00 C ATOM 0 H VAL A 42 4.750 -8.718 -12.585 1.00 0.00 H new ATOM 0 HA VAL A 42 7.091 -7.284 -11.546 1.00 0.00 H new ATOM 0 HB VAL A 42 7.199 -6.339 -13.579 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.268 -5.679 -15.012 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.293 -7.426 -14.671 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.161 -6.365 -13.799 1.00 0.00 H new ATOM 0 HG21 VAL A 42 6.126 -4.078 -13.452 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.078 -4.675 -12.143 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.838 -4.574 -11.898 1.00 0.00 H new ATOM 647 N HIS A 43 5.555 -6.730 -9.708 1.00 0.00 N ATOM 648 CA HIS A 43 4.721 -6.330 -8.584 1.00 0.00 C ATOM 649 C HIS A 43 5.516 -5.469 -7.607 1.00 0.00 C ATOM 650 O HIS A 43 6.746 -5.467 -7.626 1.00 0.00 O ATOM 651 CB HIS A 43 4.199 -7.573 -7.858 1.00 0.00 C ATOM 652 CG HIS A 43 3.281 -8.435 -8.684 1.00 0.00 C ATOM 653 ND1 HIS A 43 1.904 -8.434 -8.637 1.00 0.00 N ATOM 654 CD2 HIS A 43 3.665 -9.362 -9.616 1.00 0.00 C ATOM 655 CE1 HIS A 43 1.472 -9.346 -9.527 1.00 0.00 C ATOM 656 NE2 HIS A 43 2.507 -9.936 -10.149 1.00 0.00 N ATOM 0 H HIS A 43 6.527 -6.909 -9.455 1.00 0.00 H new ATOM 0 HA HIS A 43 3.882 -5.748 -8.965 1.00 0.00 H new ATOM 0 HB2 HIS A 43 5.049 -8.174 -7.535 1.00 0.00 H new ATOM 0 HB3 HIS A 43 3.670 -7.258 -6.958 1.00 0.00 H new ATOM 0 HD2 HIS A 43 4.681 -9.606 -9.890 1.00 0.00 H new ATOM 0 HE1 HIS A 43 0.433 -9.573 -9.716 1.00 0.00 H new ATOM 0 HE2 HIS A 43 2.458 -10.659 -10.867 1.00 0.00 H new ATOM 664 N ARG A 44 4.805 -4.734 -6.746 1.00 0.00 N ATOM 665 CA ARG A 44 5.419 -3.940 -5.689 1.00 0.00 C ATOM 666 C ARG A 44 5.734 -4.829 -4.485 1.00 0.00 C ATOM 667 O ARG A 44 5.287 -5.973 -4.423 1.00 0.00 O ATOM 668 CB ARG A 44 4.498 -2.766 -5.339 1.00 0.00 C ATOM 669 CG ARG A 44 3.152 -3.263 -4.814 1.00 0.00 C ATOM 670 CD ARG A 44 2.210 -2.100 -4.527 1.00 0.00 C ATOM 671 NE ARG A 44 1.453 -1.684 -5.712 1.00 0.00 N ATOM 672 CZ ARG A 44 0.545 -0.704 -5.687 1.00 0.00 C ATOM 673 NH1 ARG A 44 0.296 -0.033 -4.564 1.00 0.00 N ATOM 674 NH2 ARG A 44 -0.122 -0.390 -6.792 1.00 0.00 N ATOM 0 H ARG A 44 3.787 -4.676 -6.766 1.00 0.00 H new ATOM 0 HA ARG A 44 6.367 -3.522 -6.026 1.00 0.00 H new ATOM 0 HB2 ARG A 44 4.975 -2.136 -4.588 1.00 0.00 H new ATOM 0 HB3 ARG A 44 4.342 -2.146 -6.222 1.00 0.00 H new ATOM 0 HG2 ARG A 44 2.697 -3.931 -5.546 1.00 0.00 H new ATOM 0 HG3 ARG A 44 3.305 -3.844 -3.904 1.00 0.00 H new ATOM 0 HD2 ARG A 44 1.515 -2.386 -3.738 1.00 0.00 H new ATOM 0 HD3 ARG A 44 2.786 -1.254 -4.153 1.00 0.00 H new ATOM 0 HE ARG A 44 1.627 -2.164 -6.595 1.00 0.00 H new ATOM 0 HH11 ARG A 44 0.801 -0.265 -3.709 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -0.400 0.713 -4.559 1.00 0.00 H new ATOM 0 HH21 ARG A 44 0.059 -0.897 -7.658 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -0.815 0.358 -6.774 1.00 0.00 H new ATOM 688 N GLU A 45 6.504 -4.314 -3.524 1.00 0.00 N ATOM 689 CA GLU A 45 7.002 -5.127 -2.419 1.00 0.00 C ATOM 690 C GLU A 45 5.900 -5.602 -1.468 1.00 0.00 C ATOM 691 O GLU A 45 6.008 -6.687 -0.898 1.00 0.00 O ATOM 692 CB GLU A 45 8.101 -4.370 -1.658 1.00 0.00 C ATOM 693 CG GLU A 45 7.597 -3.244 -0.746 1.00 0.00 C ATOM 694 CD GLU A 45 7.048 -2.044 -1.520 1.00 0.00 C ATOM 695 OE1 GLU A 45 5.881 -2.119 -1.963 1.00 0.00 O ATOM 696 OE2 GLU A 45 7.809 -1.060 -1.658 1.00 0.00 O ATOM 0 H GLU A 45 6.795 -3.337 -3.491 1.00 0.00 H new ATOM 0 HA GLU A 45 7.424 -6.031 -2.858 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.662 -5.083 -1.054 1.00 0.00 H new ATOM 0 HB3 GLU A 45 8.798 -3.947 -2.381 1.00 0.00 H new ATOM 0 HG2 GLU A 45 6.817 -3.635 -0.093 1.00 0.00 H new ATOM 0 HG3 GLU A 45 8.413 -2.912 -0.104 1.00 0.00 H new ATOM 703 N GLU A 46 4.841 -4.806 -1.288 1.00 0.00 N ATOM 704 CA GLU A 46 3.728 -5.156 -0.411 1.00 0.00 C ATOM 705 C GLU A 46 2.689 -6.019 -1.128 1.00 0.00 C ATOM 706 O GLU A 46 1.645 -6.328 -0.554 1.00 0.00 O ATOM 707 CB GLU A 46 3.059 -3.882 0.112 1.00 0.00 C ATOM 708 CG GLU A 46 4.005 -3.089 1.013 1.00 0.00 C ATOM 709 CD GLU A 46 3.281 -1.909 1.659 1.00 0.00 C ATOM 710 OE1 GLU A 46 3.032 -0.916 0.939 1.00 0.00 O ATOM 711 OE2 GLU A 46 2.979 -2.010 2.870 1.00 0.00 O ATOM 0 H GLU A 46 4.735 -3.902 -1.748 1.00 0.00 H new ATOM 0 HA GLU A 46 4.132 -5.735 0.420 1.00 0.00 H new ATOM 0 HB2 GLU A 46 2.747 -3.261 -0.728 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.158 -4.143 0.667 1.00 0.00 H new ATOM 0 HG2 GLU A 46 4.408 -3.741 1.787 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.851 -2.726 0.429 1.00 0.00 H new ATOM 718 N ILE A 47 2.960 -6.410 -2.377 1.00 0.00 N ATOM 719 CA ILE A 47 1.996 -7.119 -3.209 1.00 0.00 C ATOM 720 C ILE A 47 2.597 -8.387 -3.808 1.00 0.00 C ATOM 721 O ILE A 47 1.858 -9.321 -4.106 1.00 0.00 O ATOM 722 CB ILE A 47 1.532 -6.145 -4.295 1.00 0.00 C ATOM 723 CG1 ILE A 47 0.614 -5.061 -3.710 1.00 0.00 C ATOM 724 CG2 ILE A 47 0.841 -6.803 -5.484 1.00 0.00 C ATOM 725 CD1 ILE A 47 -0.760 -5.586 -3.295 1.00 0.00 C ATOM 0 H ILE A 47 3.855 -6.242 -2.835 1.00 0.00 H new ATOM 0 HA ILE A 47 1.147 -7.448 -2.610 1.00 0.00 H new ATOM 0 HB ILE A 47 2.451 -5.700 -4.676 1.00 0.00 H new ATOM 0 HG12 ILE A 47 1.100 -4.613 -2.843 1.00 0.00 H new ATOM 0 HG13 ILE A 47 0.484 -4.269 -4.447 1.00 0.00 H new ATOM 0 HG21 ILE A 47 0.547 -6.038 -6.203 1.00 0.00 H new ATOM 0 HG22 ILE A 47 1.526 -7.504 -5.960 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -0.044 -7.338 -5.140 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -1.355 -4.767 -2.891 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -1.266 -6.008 -4.163 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -0.640 -6.357 -2.534 1.00 0.00 H new ATOM 737 N TYR A 48 3.920 -8.446 -3.995 1.00 0.00 N ATOM 738 CA TYR A 48 4.537 -9.670 -4.479 1.00 0.00 C ATOM 739 C TYR A 48 4.419 -10.764 -3.420 1.00 0.00 C ATOM 740 O TYR A 48 4.056 -11.896 -3.730 1.00 0.00 O ATOM 741 CB TYR A 48 6.009 -9.439 -4.809 1.00 0.00 C ATOM 742 CG TYR A 48 6.693 -10.741 -5.155 1.00 0.00 C ATOM 743 CD1 TYR A 48 6.555 -11.286 -6.440 1.00 0.00 C ATOM 744 CD2 TYR A 48 7.454 -11.408 -4.183 1.00 0.00 C ATOM 745 CE1 TYR A 48 7.159 -12.513 -6.749 1.00 0.00 C ATOM 746 CE2 TYR A 48 8.057 -12.636 -4.483 1.00 0.00 C ATOM 747 CZ TYR A 48 7.916 -13.193 -5.772 1.00 0.00 C ATOM 748 OH TYR A 48 8.508 -14.383 -6.074 1.00 0.00 O ATOM 0 H TYR A 48 4.566 -7.676 -3.821 1.00 0.00 H new ATOM 0 HA TYR A 48 4.019 -9.980 -5.386 1.00 0.00 H new ATOM 0 HB2 TYR A 48 6.094 -8.745 -5.645 1.00 0.00 H new ATOM 0 HB3 TYR A 48 6.509 -8.976 -3.958 1.00 0.00 H new ATOM 0 HD1 TYR A 48 5.984 -10.761 -7.191 1.00 0.00 H new ATOM 0 HD2 TYR A 48 7.575 -10.974 -3.202 1.00 0.00 H new ATOM 0 HE1 TYR A 48 7.045 -12.938 -7.735 1.00 0.00 H new ATOM 0 HE2 TYR A 48 8.629 -13.156 -3.729 1.00 0.00 H new ATOM 0 HH TYR A 48 8.992 -14.716 -5.289 1.00 0.00 H new ATOM 846 N MET B 1 2.784 -1.900 -21.053 1.00 0.00 N ATOM 847 CA MET B 1 3.471 -1.333 -19.877 1.00 0.00 C ATOM 848 C MET B 1 2.550 -1.342 -18.663 1.00 0.00 C ATOM 849 O MET B 1 1.336 -1.236 -18.809 1.00 0.00 O ATOM 850 CB MET B 1 3.977 0.079 -20.193 1.00 0.00 C ATOM 851 CG MET B 1 4.628 0.741 -18.981 1.00 0.00 C ATOM 852 SD MET B 1 5.762 2.095 -19.389 1.00 0.00 S ATOM 853 CE MET B 1 4.606 3.223 -20.206 1.00 0.00 C ATOM 0 H1 MET B 1 2.975 -1.307 -21.886 1.00 0.00 H new ATOM 0 H2 MET B 1 3.133 -2.864 -21.227 1.00 0.00 H new ATOM 0 H3 MET B 1 1.760 -1.929 -20.876 1.00 0.00 H new ATOM 0 HA MET B 1 4.335 -1.953 -19.636 1.00 0.00 H new ATOM 0 HB2 MET B 1 4.697 0.031 -21.010 1.00 0.00 H new ATOM 0 HB3 MET B 1 3.145 0.693 -20.537 1.00 0.00 H new ATOM 0 HG2 MET B 1 3.845 1.124 -18.326 1.00 0.00 H new ATOM 0 HG3 MET B 1 5.173 -0.016 -18.417 1.00 0.00 H new ATOM 0 HE1 MET B 1 5.121 4.149 -20.463 1.00 0.00 H new ATOM 0 HE2 MET B 1 4.223 2.757 -21.114 1.00 0.00 H new ATOM 0 HE3 MET B 1 3.777 3.443 -19.534 1.00 0.00 H new ATOM 865 N LEU B 2 3.136 -1.468 -17.467 1.00 0.00 N ATOM 866 CA LEU B 2 2.422 -1.484 -16.198 1.00 0.00 C ATOM 867 C LEU B 2 2.819 -0.247 -15.394 1.00 0.00 C ATOM 868 O LEU B 2 3.949 -0.151 -14.919 1.00 0.00 O ATOM 869 CB LEU B 2 2.793 -2.764 -15.437 1.00 0.00 C ATOM 870 CG LEU B 2 1.746 -3.220 -14.411 1.00 0.00 C ATOM 871 CD1 LEU B 2 2.430 -3.894 -13.234 1.00 0.00 C ATOM 872 CD2 LEU B 2 0.861 -2.116 -13.858 1.00 0.00 C ATOM 0 H LEU B 2 4.146 -1.564 -17.359 1.00 0.00 H new ATOM 0 HA LEU B 2 1.344 -1.469 -16.362 1.00 0.00 H new ATOM 0 HB2 LEU B 2 2.951 -3.567 -16.157 1.00 0.00 H new ATOM 0 HB3 LEU B 2 3.741 -2.605 -14.924 1.00 0.00 H new ATOM 0 HG LEU B 2 1.100 -3.902 -14.964 1.00 0.00 H new ATOM 0 HD11 LEU B 2 1.679 -4.214 -12.511 1.00 0.00 H new ATOM 0 HD12 LEU B 2 2.988 -4.762 -13.586 1.00 0.00 H new ATOM 0 HD13 LEU B 2 3.114 -3.191 -12.759 1.00 0.00 H new ATOM 0 HD21 LEU B 2 0.156 -2.539 -13.143 1.00 0.00 H new ATOM 0 HD22 LEU B 2 1.479 -1.369 -13.360 1.00 0.00 H new ATOM 0 HD23 LEU B 2 0.312 -1.647 -14.674 1.00 0.00 H new ATOM 884 N ILE B 3 1.897 0.705 -15.238 1.00 0.00 N ATOM 885 CA ILE B 3 2.169 1.943 -14.531 1.00 0.00 C ATOM 886 C ILE B 3 2.006 1.711 -13.033 1.00 0.00 C ATOM 887 O ILE B 3 1.100 0.991 -12.615 1.00 0.00 O ATOM 888 CB ILE B 3 1.193 3.047 -14.964 1.00 0.00 C ATOM 889 CG1 ILE B 3 0.903 3.155 -16.471 1.00 0.00 C ATOM 890 CG2 ILE B 3 1.726 4.396 -14.462 1.00 0.00 C ATOM 891 CD1 ILE B 3 1.929 2.568 -17.435 1.00 0.00 C ATOM 0 H ILE B 3 0.946 0.633 -15.600 1.00 0.00 H new ATOM 0 HA ILE B 3 3.187 2.256 -14.765 1.00 0.00 H new ATOM 0 HB ILE B 3 0.238 2.770 -14.518 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -0.054 2.670 -16.664 1.00 0.00 H new ATOM 0 HG13 ILE B 3 0.780 4.210 -16.714 1.00 0.00 H new ATOM 0 HG21 ILE B 3 1.043 5.191 -14.762 1.00 0.00 H new ATOM 0 HG22 ILE B 3 1.804 4.375 -13.375 1.00 0.00 H new ATOM 0 HG23 ILE B 3 2.710 4.581 -14.892 1.00 0.00 H new ATOM 0 HD11 ILE B 3 1.592 2.717 -18.461 1.00 0.00 H new ATOM 0 HD12 ILE B 3 2.888 3.065 -17.293 1.00 0.00 H new ATOM 0 HD13 ILE B 3 2.041 1.501 -17.242 1.00 0.00 H new ATOM 903 N LEU B 4 2.876 2.317 -12.226 1.00 0.00 N ATOM 904 CA LEU B 4 2.767 2.285 -10.778 1.00 0.00 C ATOM 905 C LEU B 4 3.151 3.658 -10.238 1.00 0.00 C ATOM 906 O LEU B 4 4.307 4.065 -10.342 1.00 0.00 O ATOM 907 CB LEU B 4 3.681 1.208 -10.182 1.00 0.00 C ATOM 908 CG LEU B 4 3.220 -0.218 -10.501 1.00 0.00 C ATOM 909 CD1 LEU B 4 4.197 -1.212 -9.881 1.00 0.00 C ATOM 910 CD2 LEU B 4 1.853 -0.518 -9.891 1.00 0.00 C ATOM 0 H LEU B 4 3.679 2.846 -12.566 1.00 0.00 H new ATOM 0 HA LEU B 4 1.743 2.041 -10.496 1.00 0.00 H new ATOM 0 HB2 LEU B 4 4.693 1.349 -10.561 1.00 0.00 H new ATOM 0 HB3 LEU B 4 3.725 1.336 -9.100 1.00 0.00 H new ATOM 0 HG LEU B 4 3.171 -0.306 -11.586 1.00 0.00 H new ATOM 0 HD11 LEU B 4 3.873 -2.228 -10.105 1.00 0.00 H new ATOM 0 HD12 LEU B 4 5.193 -1.049 -10.293 1.00 0.00 H new ATOM 0 HD13 LEU B 4 4.224 -1.070 -8.801 1.00 0.00 H new ATOM 0 HD21 LEU B 4 1.560 -1.538 -10.139 1.00 0.00 H new ATOM 0 HD22 LEU B 4 1.906 -0.409 -8.808 1.00 0.00 H new ATOM 0 HD23 LEU B 4 1.116 0.178 -10.290 1.00 0.00 H new ATOM 922 N THR B 5 2.181 4.374 -9.663 1.00 0.00 N ATOM 923 CA THR B 5 2.422 5.670 -9.046 1.00 0.00 C ATOM 924 C THR B 5 3.114 5.449 -7.704 1.00 0.00 C ATOM 925 O THR B 5 2.511 5.618 -6.645 1.00 0.00 O ATOM 926 CB THR B 5 1.098 6.427 -8.904 1.00 0.00 C ATOM 927 OG1 THR B 5 0.469 6.470 -10.162 1.00 0.00 O ATOM 928 CG2 THR B 5 1.319 7.862 -8.437 1.00 0.00 C ATOM 0 H THR B 5 1.209 4.067 -9.615 1.00 0.00 H new ATOM 0 HA THR B 5 3.075 6.283 -9.667 1.00 0.00 H new ATOM 0 HB THR B 5 0.487 5.909 -8.165 1.00 0.00 H new ATOM 0 HG1 THR B 5 -0.382 6.951 -10.086 1.00 0.00 H new ATOM 0 HG21 THR B 5 0.358 8.368 -8.348 1.00 0.00 H new ATOM 0 HG22 THR B 5 1.817 7.856 -7.468 1.00 0.00 H new ATOM 0 HG23 THR B 5 1.940 8.389 -9.161 1.00 0.00 H new ATOM 936 N ARG B 6 4.392 5.066 -7.755 1.00 0.00 N ATOM 937 CA ARG B 6 5.187 4.724 -6.585 1.00 0.00 C ATOM 938 C ARG B 6 5.384 5.961 -5.711 1.00 0.00 C ATOM 939 O ARG B 6 5.036 7.066 -6.122 1.00 0.00 O ATOM 940 CB ARG B 6 6.517 4.145 -7.085 1.00 0.00 C ATOM 941 CG ARG B 6 7.321 3.350 -6.049 1.00 0.00 C ATOM 942 CD ARG B 6 6.673 2.007 -5.699 1.00 0.00 C ATOM 943 NE ARG B 6 5.531 2.168 -4.793 1.00 0.00 N ATOM 944 CZ ARG B 6 4.293 1.717 -5.002 1.00 0.00 C ATOM 945 NH1 ARG B 6 3.980 1.036 -6.102 1.00 0.00 N ATOM 946 NH2 ARG B 6 3.356 1.958 -4.091 1.00 0.00 N ATOM 0 H ARG B 6 4.909 4.985 -8.631 1.00 0.00 H new ATOM 0 HA ARG B 6 4.687 3.981 -5.964 1.00 0.00 H new ATOM 0 HB2 ARG B 6 6.314 3.496 -7.937 1.00 0.00 H new ATOM 0 HB3 ARG B 6 7.136 4.965 -7.449 1.00 0.00 H new ATOM 0 HG2 ARG B 6 8.326 3.174 -6.433 1.00 0.00 H new ATOM 0 HG3 ARG B 6 7.425 3.945 -5.142 1.00 0.00 H new ATOM 0 HD2 ARG B 6 6.344 1.514 -6.614 1.00 0.00 H new ATOM 0 HD3 ARG B 6 7.415 1.356 -5.236 1.00 0.00 H new ATOM 0 HE ARG B 6 5.699 2.672 -3.922 1.00 0.00 H new ATOM 0 HH11 ARG B 6 4.694 0.849 -6.807 1.00 0.00 H new ATOM 0 HH12 ARG B 6 3.027 0.701 -6.240 1.00 0.00 H new ATOM 0 HH21 ARG B 6 3.588 2.481 -3.247 1.00 0.00 H new ATOM 0 HH22 ARG B 6 2.405 1.620 -4.236 1.00 0.00 H new ATOM 960 N LYS B 7 5.939 5.795 -4.508 1.00 0.00 N ATOM 961 CA LYS B 7 6.215 6.923 -3.627 1.00 0.00 C ATOM 962 C LYS B 7 7.664 6.867 -3.164 1.00 0.00 C ATOM 963 O LYS B 7 8.258 5.792 -3.113 1.00 0.00 O ATOM 964 CB LYS B 7 5.248 6.919 -2.439 1.00 0.00 C ATOM 965 CG LYS B 7 3.800 6.739 -2.904 1.00 0.00 C ATOM 966 CD LYS B 7 2.821 7.096 -1.785 1.00 0.00 C ATOM 967 CE LYS B 7 1.417 6.621 -2.157 1.00 0.00 C ATOM 968 NZ LYS B 7 0.408 7.126 -1.205 1.00 0.00 N ATOM 0 H LYS B 7 6.205 4.888 -4.125 1.00 0.00 H new ATOM 0 HA LYS B 7 6.065 7.855 -4.172 1.00 0.00 H new ATOM 0 HB2 LYS B 7 5.515 6.116 -1.752 1.00 0.00 H new ATOM 0 HB3 LYS B 7 5.342 7.854 -1.887 1.00 0.00 H new ATOM 0 HG2 LYS B 7 3.611 7.370 -3.773 1.00 0.00 H new ATOM 0 HG3 LYS B 7 3.640 5.708 -3.218 1.00 0.00 H new ATOM 0 HD2 LYS B 7 3.137 6.632 -0.851 1.00 0.00 H new ATOM 0 HD3 LYS B 7 2.819 8.174 -1.621 1.00 0.00 H new ATOM 0 HE2 LYS B 7 1.171 6.960 -3.164 1.00 0.00 H new ATOM 0 HE3 LYS B 7 1.392 5.531 -2.172 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -0.534 6.786 -1.485 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 0.630 6.782 -0.249 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 0.416 8.166 -1.209 1.00 0.00 H new ATOM 982 N VAL B 8 8.234 8.026 -2.826 1.00 0.00 N ATOM 983 CA VAL B 8 9.633 8.132 -2.430 1.00 0.00 C ATOM 984 C VAL B 8 9.935 7.191 -1.266 1.00 0.00 C ATOM 985 O VAL B 8 9.294 7.263 -0.218 1.00 0.00 O ATOM 986 CB VAL B 8 9.943 9.582 -2.053 1.00 0.00 C ATOM 987 CG1 VAL B 8 11.371 9.703 -1.522 1.00 0.00 C ATOM 988 CG2 VAL B 8 9.788 10.479 -3.282 1.00 0.00 C ATOM 0 H VAL B 8 7.735 8.916 -2.820 1.00 0.00 H new ATOM 0 HA VAL B 8 10.267 7.838 -3.266 1.00 0.00 H new ATOM 0 HB VAL B 8 9.246 9.894 -1.276 1.00 0.00 H new ATOM 0 HG11 VAL B 8 11.575 10.741 -1.259 1.00 0.00 H new ATOM 0 HG12 VAL B 8 11.485 9.075 -0.638 1.00 0.00 H new ATOM 0 HG13 VAL B 8 12.073 9.379 -2.290 1.00 0.00 H new ATOM 0 HG21 VAL B 8 10.010 11.511 -3.010 1.00 0.00 H new ATOM 0 HG22 VAL B 8 10.478 10.153 -4.060 1.00 0.00 H new ATOM 0 HG23 VAL B 8 8.765 10.413 -3.654 1.00 0.00 H new ATOM 998 N GLY B 9 10.918 6.308 -1.461 1.00 0.00 N ATOM 999 CA GLY B 9 11.382 5.377 -0.444 1.00 0.00 C ATOM 1000 C GLY B 9 10.797 3.976 -0.618 1.00 0.00 C ATOM 1001 O GLY B 9 11.221 3.050 0.073 1.00 0.00 O ATOM 0 H GLY B 9 11.418 6.223 -2.346 1.00 0.00 H new ATOM 0 HA2 GLY B 9 12.470 5.319 -0.479 1.00 0.00 H new ATOM 0 HA3 GLY B 9 11.115 5.758 0.541 1.00 0.00 H new ATOM 1005 N GLU B 10 9.833 3.806 -1.528 1.00 0.00 N ATOM 1006 CA GLU B 10 9.245 2.500 -1.795 1.00 0.00 C ATOM 1007 C GLU B 10 10.019 1.787 -2.908 1.00 0.00 C ATOM 1008 O GLU B 10 10.925 2.366 -3.513 1.00 0.00 O ATOM 1009 CB GLU B 10 7.769 2.659 -2.167 1.00 0.00 C ATOM 1010 CG GLU B 10 6.997 3.346 -1.038 1.00 0.00 C ATOM 1011 CD GLU B 10 5.492 3.333 -1.295 1.00 0.00 C ATOM 1012 OE1 GLU B 10 5.104 3.502 -2.473 1.00 0.00 O ATOM 1013 OE2 GLU B 10 4.740 3.155 -0.311 1.00 0.00 O ATOM 0 H GLU B 10 9.446 4.563 -2.091 1.00 0.00 H new ATOM 0 HA GLU B 10 9.309 1.888 -0.895 1.00 0.00 H new ATOM 0 HB2 GLU B 10 7.681 3.244 -3.083 1.00 0.00 H new ATOM 0 HB3 GLU B 10 7.333 1.681 -2.370 1.00 0.00 H new ATOM 0 HG2 GLU B 10 7.209 2.844 -0.094 1.00 0.00 H new ATOM 0 HG3 GLU B 10 7.340 4.376 -0.936 1.00 0.00 H new ATOM 1020 N SER B 11 9.662 0.527 -3.180 1.00 0.00 N ATOM 1021 CA SER B 11 10.361 -0.292 -4.160 1.00 0.00 C ATOM 1022 C SER B 11 9.396 -1.127 -4.998 1.00 0.00 C ATOM 1023 O SER B 11 8.196 -1.180 -4.730 1.00 0.00 O ATOM 1024 CB SER B 11 11.346 -1.214 -3.435 1.00 0.00 C ATOM 1025 OG SER B 11 12.324 -0.456 -2.755 1.00 0.00 O ATOM 0 H SER B 11 8.882 0.053 -2.725 1.00 0.00 H new ATOM 0 HA SER B 11 10.894 0.374 -4.839 1.00 0.00 H new ATOM 0 HB2 SER B 11 10.809 -1.845 -2.727 1.00 0.00 H new ATOM 0 HB3 SER B 11 11.827 -1.879 -4.153 1.00 0.00 H new ATOM 0 HG SER B 11 13.085 -0.294 -3.351 1.00 0.00 H new ATOM 1031 N ILE B 12 9.947 -1.782 -6.023 1.00 0.00 N ATOM 1032 CA ILE B 12 9.243 -2.660 -6.947 1.00 0.00 C ATOM 1033 C ILE B 12 10.131 -3.878 -7.213 1.00 0.00 C ATOM 1034 O ILE B 12 11.326 -3.843 -6.926 1.00 0.00 O ATOM 1035 CB ILE B 12 8.962 -1.893 -8.250 1.00 0.00 C ATOM 1036 CG1 ILE B 12 8.005 -0.709 -8.054 1.00 0.00 C ATOM 1037 CG2 ILE B 12 8.414 -2.803 -9.351 1.00 0.00 C ATOM 1038 CD1 ILE B 12 6.613 -1.137 -7.593 1.00 0.00 C ATOM 0 H ILE B 12 10.942 -1.708 -6.237 1.00 0.00 H new ATOM 0 HA ILE B 12 8.292 -2.990 -6.530 1.00 0.00 H new ATOM 0 HB ILE B 12 9.931 -1.502 -8.560 1.00 0.00 H new ATOM 0 HG12 ILE B 12 8.430 -0.023 -7.321 1.00 0.00 H new ATOM 0 HG13 ILE B 12 7.918 -0.160 -8.992 1.00 0.00 H new ATOM 0 HG21 ILE B 12 8.231 -2.216 -10.251 1.00 0.00 H new ATOM 0 HG22 ILE B 12 9.139 -3.587 -9.570 1.00 0.00 H new ATOM 0 HG23 ILE B 12 7.480 -3.256 -9.018 1.00 0.00 H new ATOM 0 HD11 ILE B 12 5.983 -0.256 -7.472 1.00 0.00 H new ATOM 0 HD12 ILE B 12 6.171 -1.800 -8.337 1.00 0.00 H new ATOM 0 HD13 ILE B 12 6.690 -1.661 -6.640 1.00 0.00 H new ATOM 1050 N ASN B 13 9.562 -4.957 -7.758 1.00 0.00 N ATOM 1051 CA ASN B 13 10.334 -6.139 -8.098 1.00 0.00 C ATOM 1052 C ASN B 13 9.915 -6.675 -9.466 1.00 0.00 C ATOM 1053 O ASN B 13 8.758 -6.533 -9.861 1.00 0.00 O ATOM 1054 CB ASN B 13 10.147 -7.183 -6.998 1.00 0.00 C ATOM 1055 CG ASN B 13 11.262 -8.211 -7.044 1.00 0.00 C ATOM 1056 OD1 ASN B 13 11.111 -9.284 -7.620 1.00 0.00 O ATOM 1057 ND2 ASN B 13 12.392 -7.876 -6.432 1.00 0.00 N ATOM 0 H ASN B 13 8.567 -5.029 -7.971 1.00 0.00 H new ATOM 0 HA ASN B 13 11.393 -5.888 -8.165 1.00 0.00 H new ATOM 0 HB2 ASN B 13 10.135 -6.695 -6.024 1.00 0.00 H new ATOM 0 HB3 ASN B 13 9.183 -7.678 -7.118 1.00 0.00 H new ATOM 0 HD21 ASN B 13 13.181 -8.523 -6.428 1.00 0.00 H new ATOM 0 HD22 ASN B 13 12.471 -6.972 -5.966 1.00 0.00 H new ATOM 1064 N ILE B 14 10.856 -7.294 -10.187 1.00 0.00 N ATOM 1065 CA ILE B 14 10.618 -7.802 -11.531 1.00 0.00 C ATOM 1066 C ILE B 14 11.359 -9.122 -11.729 1.00 0.00 C ATOM 1067 O ILE B 14 12.547 -9.220 -11.429 1.00 0.00 O ATOM 1068 CB ILE B 14 11.093 -6.779 -12.577 1.00 0.00 C ATOM 1069 CG1 ILE B 14 10.445 -5.406 -12.344 1.00 0.00 C ATOM 1070 CG2 ILE B 14 10.742 -7.294 -13.977 1.00 0.00 C ATOM 1071 CD1 ILE B 14 10.964 -4.354 -13.325 1.00 0.00 C ATOM 0 H ILE B 14 11.805 -7.454 -9.849 1.00 0.00 H new ATOM 0 HA ILE B 14 9.548 -7.969 -11.657 1.00 0.00 H new ATOM 0 HB ILE B 14 12.172 -6.658 -12.485 1.00 0.00 H new ATOM 0 HG12 ILE B 14 9.363 -5.494 -12.445 1.00 0.00 H new ATOM 0 HG13 ILE B 14 10.644 -5.080 -11.323 1.00 0.00 H new ATOM 0 HG21 ILE B 14 11.076 -6.574 -14.724 1.00 0.00 H new ATOM 0 HG22 ILE B 14 11.237 -8.250 -14.148 1.00 0.00 H new ATOM 0 HG23 ILE B 14 9.663 -7.425 -14.056 1.00 0.00 H new ATOM 0 HD11 ILE B 14 10.479 -3.399 -13.124 1.00 0.00 H new ATOM 0 HD12 ILE B 14 12.042 -4.246 -13.206 1.00 0.00 H new ATOM 0 HD13 ILE B 14 10.741 -4.667 -14.345 1.00 0.00 H new ATOM 1083 N GLY B 15 10.655 -10.136 -12.237 1.00 0.00 N ATOM 1084 CA GLY B 15 11.243 -11.426 -12.581 1.00 0.00 C ATOM 1085 C GLY B 15 11.875 -12.162 -11.397 1.00 0.00 C ATOM 1086 O GLY B 15 12.539 -13.175 -11.601 1.00 0.00 O ATOM 0 H GLY B 15 9.653 -10.081 -12.421 1.00 0.00 H new ATOM 0 HA2 GLY B 15 10.471 -12.060 -13.018 1.00 0.00 H new ATOM 0 HA3 GLY B 15 12.003 -11.274 -13.348 1.00 0.00 H new ATOM 1090 N ASP B 16 11.676 -11.667 -10.170 1.00 0.00 N ATOM 1091 CA ASP B 16 12.240 -12.226 -8.945 1.00 0.00 C ATOM 1092 C ASP B 16 13.775 -12.200 -8.913 1.00 0.00 C ATOM 1093 O ASP B 16 14.376 -12.733 -7.981 1.00 0.00 O ATOM 1094 CB ASP B 16 11.662 -13.624 -8.698 1.00 0.00 C ATOM 1095 CG ASP B 16 11.998 -14.146 -7.300 1.00 0.00 C ATOM 1096 OD1 ASP B 16 11.763 -13.395 -6.327 1.00 0.00 O ATOM 1097 OD2 ASP B 16 12.489 -15.295 -7.216 1.00 0.00 O ATOM 0 H ASP B 16 11.100 -10.842 -10.002 1.00 0.00 H new ATOM 0 HA ASP B 16 11.943 -11.581 -8.118 1.00 0.00 H new ATOM 0 HB2 ASP B 16 10.580 -13.596 -8.824 1.00 0.00 H new ATOM 0 HB3 ASP B 16 12.052 -14.314 -9.446 1.00 0.00 H new ATOM 1102 N ASP B 17 14.423 -11.589 -9.913 1.00 0.00 N ATOM 1103 CA ASP B 17 15.876 -11.446 -9.937 1.00 0.00 C ATOM 1104 C ASP B 17 16.285 -9.980 -10.064 1.00 0.00 C ATOM 1105 O ASP B 17 17.473 -9.669 -10.006 1.00 0.00 O ATOM 1106 CB ASP B 17 16.487 -12.243 -11.091 1.00 0.00 C ATOM 1107 CG ASP B 17 16.128 -13.726 -11.037 1.00 0.00 C ATOM 1108 OD1 ASP B 17 16.461 -14.366 -10.013 1.00 0.00 O ATOM 1109 OD2 ASP B 17 15.523 -14.211 -12.018 1.00 0.00 O ATOM 0 H ASP B 17 13.953 -11.183 -10.722 1.00 0.00 H new ATOM 0 HA ASP B 17 16.253 -11.838 -8.993 1.00 0.00 H new ATOM 0 HB2 ASP B 17 16.145 -11.825 -12.038 1.00 0.00 H new ATOM 0 HB3 ASP B 17 17.571 -12.135 -11.068 1.00 0.00 H new ATOM 1114 N ILE B 18 15.311 -9.079 -10.236 1.00 0.00 N ATOM 1115 CA ILE B 18 15.576 -7.657 -10.363 1.00 0.00 C ATOM 1116 C ILE B 18 14.706 -6.896 -9.371 1.00 0.00 C ATOM 1117 O ILE B 18 13.556 -7.261 -9.135 1.00 0.00 O ATOM 1118 CB ILE B 18 15.311 -7.179 -11.801 1.00 0.00 C ATOM 1119 CG1 ILE B 18 16.158 -7.951 -12.821 1.00 0.00 C ATOM 1120 CG2 ILE B 18 15.643 -5.690 -11.924 1.00 0.00 C ATOM 1121 CD1 ILE B 18 15.366 -9.124 -13.402 1.00 0.00 C ATOM 0 H ILE B 18 14.322 -9.323 -10.290 1.00 0.00 H new ATOM 0 HA ILE B 18 16.626 -7.465 -10.141 1.00 0.00 H new ATOM 0 HB ILE B 18 14.257 -7.357 -12.013 1.00 0.00 H new ATOM 0 HG12 ILE B 18 16.469 -7.282 -13.624 1.00 0.00 H new ATOM 0 HG13 ILE B 18 17.066 -8.319 -12.343 1.00 0.00 H new ATOM 0 HG21 ILE B 18 15.453 -5.358 -12.945 1.00 0.00 H new ATOM 0 HG22 ILE B 18 15.019 -5.120 -11.235 1.00 0.00 H new ATOM 0 HG23 ILE B 18 16.693 -5.530 -11.680 1.00 0.00 H new ATOM 0 HD11 ILE B 18 15.984 -9.659 -14.123 1.00 0.00 H new ATOM 0 HD12 ILE B 18 15.077 -9.802 -12.599 1.00 0.00 H new ATOM 0 HD13 ILE B 18 14.471 -8.748 -13.899 1.00 0.00 H new ATOM 1133 N THR B 19 15.262 -5.832 -8.790 1.00 0.00 N ATOM 1134 CA THR B 19 14.562 -4.991 -7.836 1.00 0.00 C ATOM 1135 C THR B 19 14.764 -3.537 -8.232 1.00 0.00 C ATOM 1136 O THR B 19 15.858 -3.155 -8.648 1.00 0.00 O ATOM 1137 CB THR B 19 15.098 -5.247 -6.425 1.00 0.00 C ATOM 1138 OG1 THR B 19 15.075 -6.629 -6.141 1.00 0.00 O ATOM 1139 CG2 THR B 19 14.243 -4.535 -5.378 1.00 0.00 C ATOM 0 H THR B 19 16.219 -5.533 -8.974 1.00 0.00 H new ATOM 0 HA THR B 19 13.497 -5.222 -7.840 1.00 0.00 H new ATOM 0 HB THR B 19 16.118 -4.866 -6.386 1.00 0.00 H new ATOM 0 HG1 THR B 19 15.421 -6.783 -5.237 1.00 0.00 H new ATOM 0 HG21 THR B 19 14.645 -4.733 -4.384 1.00 0.00 H new ATOM 0 HG22 THR B 19 14.255 -3.462 -5.567 1.00 0.00 H new ATOM 0 HG23 THR B 19 13.218 -4.902 -5.435 1.00 0.00 H new ATOM 1147 N ILE B 20 13.713 -2.726 -8.106 1.00 0.00 N ATOM 1148 CA ILE B 20 13.756 -1.319 -8.481 1.00 0.00 C ATOM 1149 C ILE B 20 13.370 -0.485 -7.261 1.00 0.00 C ATOM 1150 O ILE B 20 12.629 -0.962 -6.403 1.00 0.00 O ATOM 1151 CB ILE B 20 12.798 -1.054 -9.655 1.00 0.00 C ATOM 1152 CG1 ILE B 20 12.873 -2.118 -10.761 1.00 0.00 C ATOM 1153 CG2 ILE B 20 13.058 0.326 -10.263 1.00 0.00 C ATOM 1154 CD1 ILE B 20 14.222 -2.162 -11.477 1.00 0.00 C ATOM 0 H ILE B 20 12.810 -3.029 -7.741 1.00 0.00 H new ATOM 0 HA ILE B 20 14.760 -1.044 -8.806 1.00 0.00 H new ATOM 0 HB ILE B 20 11.794 -1.098 -9.233 1.00 0.00 H new ATOM 0 HG12 ILE B 20 12.670 -3.097 -10.326 1.00 0.00 H new ATOM 0 HG13 ILE B 20 12.089 -1.925 -11.493 1.00 0.00 H new ATOM 0 HG21 ILE B 20 12.370 0.494 -11.092 1.00 0.00 H new ATOM 0 HG22 ILE B 20 12.905 1.093 -9.504 1.00 0.00 H new ATOM 0 HG23 ILE B 20 14.084 0.376 -10.627 1.00 0.00 H new ATOM 0 HD11 ILE B 20 14.202 -2.936 -12.244 1.00 0.00 H new ATOM 0 HD12 ILE B 20 14.419 -1.196 -11.941 1.00 0.00 H new ATOM 0 HD13 ILE B 20 15.009 -2.386 -10.757 1.00 0.00 H new ATOM 1166 N THR B 21 13.859 0.753 -7.173 1.00 0.00 N ATOM 1167 CA THR B 21 13.577 1.621 -6.037 1.00 0.00 C ATOM 1168 C THR B 21 13.458 3.069 -6.500 1.00 0.00 C ATOM 1169 O THR B 21 13.996 3.433 -7.543 1.00 0.00 O ATOM 1170 CB THR B 21 14.706 1.473 -5.008 1.00 0.00 C ATOM 1171 OG1 THR B 21 14.841 0.118 -4.638 1.00 0.00 O ATOM 1172 CG2 THR B 21 14.441 2.277 -3.737 1.00 0.00 C ATOM 0 H THR B 21 14.457 1.176 -7.883 1.00 0.00 H new ATOM 0 HA THR B 21 12.631 1.335 -5.578 1.00 0.00 H new ATOM 0 HB THR B 21 15.613 1.849 -5.481 1.00 0.00 H new ATOM 0 HG1 THR B 21 15.564 0.028 -3.982 1.00 0.00 H new ATOM 0 HG21 THR B 21 15.268 2.139 -3.040 1.00 0.00 H new ATOM 0 HG22 THR B 21 14.349 3.334 -3.987 1.00 0.00 H new ATOM 0 HG23 THR B 21 13.516 1.932 -3.275 1.00 0.00 H new ATOM 1180 N ILE B 22 12.752 3.895 -5.722 1.00 0.00 N ATOM 1181 CA ILE B 22 12.616 5.321 -5.986 1.00 0.00 C ATOM 1182 C ILE B 22 13.219 6.083 -4.809 1.00 0.00 C ATOM 1183 O ILE B 22 12.563 6.330 -3.799 1.00 0.00 O ATOM 1184 CB ILE B 22 11.149 5.675 -6.286 1.00 0.00 C ATOM 1185 CG1 ILE B 22 10.908 7.189 -6.332 1.00 0.00 C ATOM 1186 CG2 ILE B 22 10.193 5.062 -5.265 1.00 0.00 C ATOM 1187 CD1 ILE B 22 11.717 7.852 -7.444 1.00 0.00 C ATOM 0 H ILE B 22 12.257 3.585 -4.886 1.00 0.00 H new ATOM 0 HA ILE B 22 13.165 5.616 -6.880 1.00 0.00 H new ATOM 0 HB ILE B 22 10.948 5.255 -7.271 1.00 0.00 H new ATOM 0 HG12 ILE B 22 9.847 7.385 -6.487 1.00 0.00 H new ATOM 0 HG13 ILE B 22 11.177 7.630 -5.372 1.00 0.00 H new ATOM 0 HG21 ILE B 22 9.168 5.337 -5.515 1.00 0.00 H new ATOM 0 HG22 ILE B 22 10.291 3.977 -5.281 1.00 0.00 H new ATOM 0 HG23 ILE B 22 10.436 5.434 -4.270 1.00 0.00 H new ATOM 0 HD11 ILE B 22 11.521 8.924 -7.447 1.00 0.00 H new ATOM 0 HD12 ILE B 22 12.780 7.678 -7.275 1.00 0.00 H new ATOM 0 HD13 ILE B 22 11.429 7.428 -8.406 1.00 0.00 H new ATOM 1199 N LEU B 23 14.493 6.458 -4.949 1.00 0.00 N ATOM 1200 CA LEU B 23 15.237 7.103 -3.880 1.00 0.00 C ATOM 1201 C LEU B 23 14.741 8.525 -3.647 1.00 0.00 C ATOM 1202 O LEU B 23 14.917 9.058 -2.553 1.00 0.00 O ATOM 1203 CB LEU B 23 16.729 7.123 -4.223 1.00 0.00 C ATOM 1204 CG LEU B 23 17.286 5.721 -4.481 1.00 0.00 C ATOM 1205 CD1 LEU B 23 18.788 5.815 -4.740 1.00 0.00 C ATOM 1206 CD2 LEU B 23 17.068 4.815 -3.273 1.00 0.00 C ATOM 0 H LEU B 23 15.030 6.321 -5.805 1.00 0.00 H new ATOM 0 HA LEU B 23 15.081 6.533 -2.964 1.00 0.00 H new ATOM 0 HB2 LEU B 23 16.888 7.743 -5.106 1.00 0.00 H new ATOM 0 HB3 LEU B 23 17.281 7.586 -3.405 1.00 0.00 H new ATOM 0 HG LEU B 23 16.766 5.303 -5.343 1.00 0.00 H new ATOM 0 HD11 LEU B 23 19.189 4.818 -4.924 1.00 0.00 H new ATOM 0 HD12 LEU B 23 18.968 6.445 -5.611 1.00 0.00 H new ATOM 0 HD13 LEU B 23 19.281 6.249 -3.870 1.00 0.00 H new ATOM 0 HD21 LEU B 23 17.473 3.825 -3.483 1.00 0.00 H new ATOM 0 HD22 LEU B 23 17.574 5.238 -2.405 1.00 0.00 H new ATOM 0 HD23 LEU B 23 16.001 4.734 -3.067 1.00 0.00 H new ATOM 1218 N GLY B 24 14.124 9.144 -4.659 1.00 0.00 N ATOM 1219 CA GLY B 24 13.520 10.450 -4.451 1.00 0.00 C ATOM 1220 C GLY B 24 13.346 11.251 -5.732 1.00 0.00 C ATOM 1221 O GLY B 24 13.610 10.769 -6.831 1.00 0.00 O ATOM 0 H GLY B 24 14.034 8.769 -5.603 1.00 0.00 H new ATOM 0 HA2 GLY B 24 12.546 10.320 -3.979 1.00 0.00 H new ATOM 0 HA3 GLY B 24 14.137 11.020 -3.757 1.00 0.00 H new ATOM 1225 N VAL B 25 12.890 12.495 -5.564 1.00 0.00 N ATOM 1226 CA VAL B 25 12.653 13.432 -6.648 1.00 0.00 C ATOM 1227 C VAL B 25 13.476 14.695 -6.401 1.00 0.00 C ATOM 1228 O VAL B 25 13.740 15.058 -5.256 1.00 0.00 O ATOM 1229 CB VAL B 25 11.147 13.715 -6.749 1.00 0.00 C ATOM 1230 CG1 VAL B 25 10.587 14.292 -5.449 1.00 0.00 C ATOM 1231 CG2 VAL B 25 10.838 14.688 -7.887 1.00 0.00 C ATOM 0 H VAL B 25 12.672 12.881 -4.645 1.00 0.00 H new ATOM 0 HA VAL B 25 12.970 13.016 -7.605 1.00 0.00 H new ATOM 0 HB VAL B 25 10.670 12.755 -6.948 1.00 0.00 H new ATOM 0 HG11 VAL B 25 9.519 14.478 -5.564 1.00 0.00 H new ATOM 0 HG12 VAL B 25 10.747 13.582 -4.637 1.00 0.00 H new ATOM 0 HG13 VAL B 25 11.095 15.228 -5.218 1.00 0.00 H new ATOM 0 HG21 VAL B 25 9.764 14.867 -7.931 1.00 0.00 H new ATOM 0 HG22 VAL B 25 11.356 15.631 -7.710 1.00 0.00 H new ATOM 0 HG23 VAL B 25 11.174 14.261 -8.832 1.00 0.00 H new ATOM 1241 N SER B 26 13.878 15.362 -7.484 1.00 0.00 N ATOM 1242 CA SER B 26 14.690 16.569 -7.426 1.00 0.00 C ATOM 1243 C SER B 26 14.254 17.499 -8.550 1.00 0.00 C ATOM 1244 O SER B 26 14.907 17.580 -9.589 1.00 0.00 O ATOM 1245 CB SER B 26 16.173 16.215 -7.561 1.00 0.00 C ATOM 1246 OG SER B 26 16.574 15.361 -6.508 1.00 0.00 O ATOM 0 H SER B 26 13.644 15.073 -8.434 1.00 0.00 H new ATOM 0 HA SER B 26 14.552 17.067 -6.466 1.00 0.00 H new ATOM 0 HB2 SER B 26 16.351 15.729 -8.520 1.00 0.00 H new ATOM 0 HB3 SER B 26 16.773 17.125 -7.548 1.00 0.00 H new ATOM 0 HG SER B 26 17.524 15.142 -6.608 1.00 0.00 H new ATOM 1252 N GLY B 27 13.142 18.205 -8.340 1.00 0.00 N ATOM 1253 CA GLY B 27 12.576 19.058 -9.367 1.00 0.00 C ATOM 1254 C GLY B 27 12.117 18.207 -10.549 1.00 0.00 C ATOM 1255 O GLY B 27 11.388 17.233 -10.370 1.00 0.00 O ATOM 0 H GLY B 27 12.620 18.198 -7.464 1.00 0.00 H new ATOM 0 HA2 GLY B 27 11.734 19.620 -8.963 1.00 0.00 H new ATOM 0 HA3 GLY B 27 13.317 19.786 -9.697 1.00 0.00 H new ATOM 1259 N GLN B 28 12.546 18.574 -11.759 1.00 0.00 N ATOM 1260 CA GLN B 28 12.198 17.843 -12.969 1.00 0.00 C ATOM 1261 C GLN B 28 12.922 16.494 -13.041 1.00 0.00 C ATOM 1262 O GLN B 28 12.614 15.677 -13.910 1.00 0.00 O ATOM 1263 CB GLN B 28 12.552 18.712 -14.180 1.00 0.00 C ATOM 1264 CG GLN B 28 11.799 18.286 -15.443 1.00 0.00 C ATOM 1265 CD GLN B 28 10.297 18.505 -15.301 1.00 0.00 C ATOM 1266 OE1 GLN B 28 9.516 17.559 -15.346 1.00 0.00 O ATOM 1267 NE2 GLN B 28 9.877 19.756 -15.126 1.00 0.00 N ATOM 0 H GLN B 28 13.143 19.385 -11.922 1.00 0.00 H new ATOM 0 HA GLN B 28 11.129 17.628 -12.962 1.00 0.00 H new ATOM 0 HB2 GLN B 28 12.321 19.754 -13.956 1.00 0.00 H new ATOM 0 HB3 GLN B 28 13.625 18.655 -14.363 1.00 0.00 H new ATOM 0 HG2 GLN B 28 12.171 18.852 -16.297 1.00 0.00 H new ATOM 0 HG3 GLN B 28 11.996 17.234 -15.647 1.00 0.00 H new ATOM 0 HE21 GLN B 28 10.551 20.520 -15.093 1.00 0.00 H new ATOM 0 HE22 GLN B 28 8.881 19.950 -15.025 1.00 0.00 H new ATOM 1276 N GLN B 29 13.881 16.250 -12.137 1.00 0.00 N ATOM 1277 CA GLN B 29 14.636 15.005 -12.140 1.00 0.00 C ATOM 1278 C GLN B 29 14.099 14.033 -11.093 1.00 0.00 C ATOM 1279 O GLN B 29 13.375 14.427 -10.179 1.00 0.00 O ATOM 1280 CB GLN B 29 16.131 15.257 -11.908 1.00 0.00 C ATOM 1281 CG GLN B 29 16.634 16.552 -12.551 1.00 0.00 C ATOM 1282 CD GLN B 29 18.145 16.517 -12.707 1.00 0.00 C ATOM 1283 OE1 GLN B 29 18.659 16.041 -13.716 1.00 0.00 O ATOM 1284 NE2 GLN B 29 18.872 17.016 -11.715 1.00 0.00 N ATOM 0 H GLN B 29 14.146 16.902 -11.399 1.00 0.00 H new ATOM 0 HA GLN B 29 14.513 14.556 -13.126 1.00 0.00 H new ATOM 0 HB2 GLN B 29 16.324 15.293 -10.836 1.00 0.00 H new ATOM 0 HB3 GLN B 29 16.700 14.417 -12.306 1.00 0.00 H new ATOM 0 HG2 GLN B 29 16.165 16.687 -13.526 1.00 0.00 H new ATOM 0 HG3 GLN B 29 16.346 17.405 -11.937 1.00 0.00 H new ATOM 0 HE21 GLN B 29 18.413 17.404 -10.891 1.00 0.00 H new ATOM 0 HE22 GLN B 29 19.890 17.012 -11.777 1.00 0.00 H new ATOM 1293 N VAL B 30 14.461 12.755 -11.230 1.00 0.00 N ATOM 1294 CA VAL B 30 14.012 11.685 -10.351 1.00 0.00 C ATOM 1295 C VAL B 30 15.137 10.669 -10.179 1.00 0.00 C ATOM 1296 O VAL B 30 15.658 10.152 -11.168 1.00 0.00 O ATOM 1297 CB VAL B 30 12.785 10.998 -10.962 1.00 0.00 C ATOM 1298 CG1 VAL B 30 12.278 9.911 -10.015 1.00 0.00 C ATOM 1299 CG2 VAL B 30 11.643 11.986 -11.199 1.00 0.00 C ATOM 0 H VAL B 30 15.086 12.434 -11.970 1.00 0.00 H new ATOM 0 HA VAL B 30 13.744 12.099 -9.379 1.00 0.00 H new ATOM 0 HB VAL B 30 13.093 10.574 -11.918 1.00 0.00 H new ATOM 0 HG11 VAL B 30 11.406 9.425 -10.453 1.00 0.00 H new ATOM 0 HG12 VAL B 30 13.063 9.172 -9.856 1.00 0.00 H new ATOM 0 HG13 VAL B 30 12.003 10.360 -9.060 1.00 0.00 H new ATOM 0 HG21 VAL B 30 10.792 11.461 -11.633 1.00 0.00 H new ATOM 0 HG22 VAL B 30 11.348 12.435 -10.251 1.00 0.00 H new ATOM 0 HG23 VAL B 30 11.974 12.768 -11.883 1.00 0.00 H new ATOM 1309 N ARG B 31 15.516 10.375 -8.931 1.00 0.00 N ATOM 1310 CA ARG B 31 16.544 9.382 -8.657 1.00 0.00 C ATOM 1311 C ARG B 31 15.905 8.018 -8.442 1.00 0.00 C ATOM 1312 O ARG B 31 15.265 7.777 -7.417 1.00 0.00 O ATOM 1313 CB ARG B 31 17.400 9.784 -7.457 1.00 0.00 C ATOM 1314 CG ARG B 31 18.525 8.762 -7.289 1.00 0.00 C ATOM 1315 CD ARG B 31 19.657 9.348 -6.450 1.00 0.00 C ATOM 1316 NE ARG B 31 20.360 10.381 -7.217 1.00 0.00 N ATOM 1317 CZ ARG B 31 21.531 10.932 -6.892 1.00 0.00 C ATOM 1318 NH1 ARG B 31 22.184 10.574 -5.790 1.00 0.00 N ATOM 1319 NH2 ARG B 31 22.046 11.857 -7.694 1.00 0.00 N ATOM 0 H ARG B 31 15.123 10.814 -8.099 1.00 0.00 H new ATOM 0 HA ARG B 31 17.206 9.325 -9.521 1.00 0.00 H new ATOM 0 HB2 ARG B 31 17.815 10.781 -7.607 1.00 0.00 H new ATOM 0 HB3 ARG B 31 16.790 9.825 -6.555 1.00 0.00 H new ATOM 0 HG2 ARG B 31 18.138 7.862 -6.811 1.00 0.00 H new ATOM 0 HG3 ARG B 31 18.905 8.466 -8.267 1.00 0.00 H new ATOM 0 HD2 ARG B 31 19.257 9.774 -5.530 1.00 0.00 H new ATOM 0 HD3 ARG B 31 20.353 8.560 -6.160 1.00 0.00 H new ATOM 0 HE ARG B 31 19.915 10.707 -8.075 1.00 0.00 H new ATOM 0 HH11 ARG B 31 21.791 9.864 -5.172 1.00 0.00 H new ATOM 0 HH12 ARG B 31 23.078 11.010 -5.563 1.00 0.00 H new ATOM 0 HH21 ARG B 31 21.547 12.134 -8.540 1.00 0.00 H new ATOM 0 HH22 ARG B 31 22.940 12.291 -7.464 1.00 0.00 H new ATOM 1333 N ILE B 32 16.096 7.138 -9.426 1.00 0.00 N ATOM 1334 CA ILE B 32 15.598 5.771 -9.425 1.00 0.00 C ATOM 1335 C ILE B 32 16.797 4.827 -9.338 1.00 0.00 C ATOM 1336 O ILE B 32 17.891 5.171 -9.782 1.00 0.00 O ATOM 1337 CB ILE B 32 14.786 5.529 -10.710 1.00 0.00 C ATOM 1338 CG1 ILE B 32 13.638 6.545 -10.794 1.00 0.00 C ATOM 1339 CG2 ILE B 32 14.226 4.104 -10.753 1.00 0.00 C ATOM 1340 CD1 ILE B 32 12.826 6.406 -12.082 1.00 0.00 C ATOM 0 H ILE B 32 16.619 7.369 -10.271 1.00 0.00 H new ATOM 0 HA ILE B 32 14.942 5.591 -8.573 1.00 0.00 H new ATOM 0 HB ILE B 32 15.451 5.655 -11.564 1.00 0.00 H new ATOM 0 HG12 ILE B 32 12.978 6.414 -9.936 1.00 0.00 H new ATOM 0 HG13 ILE B 32 14.045 7.554 -10.732 1.00 0.00 H new ATOM 0 HG21 ILE B 32 13.657 3.964 -11.672 1.00 0.00 H new ATOM 0 HG22 ILE B 32 15.048 3.389 -10.722 1.00 0.00 H new ATOM 0 HG23 ILE B 32 13.573 3.944 -9.895 1.00 0.00 H new ATOM 0 HD11 ILE B 32 12.027 7.148 -12.090 1.00 0.00 H new ATOM 0 HD12 ILE B 32 13.477 6.564 -12.942 1.00 0.00 H new ATOM 0 HD13 ILE B 32 12.394 5.407 -12.134 1.00 0.00 H new ATOM 1352 N GLY B 33 16.594 3.636 -8.770 1.00 0.00 N ATOM 1353 CA GLY B 33 17.643 2.636 -8.660 1.00 0.00 C ATOM 1354 C GLY B 33 17.201 1.336 -9.316 1.00 0.00 C ATOM 1355 O GLY B 33 16.026 0.980 -9.258 1.00 0.00 O ATOM 0 H GLY B 33 15.699 3.344 -8.377 1.00 0.00 H new ATOM 0 HA2 GLY B 33 18.554 3.000 -9.135 1.00 0.00 H new ATOM 0 HA3 GLY B 33 17.879 2.460 -7.611 1.00 0.00 H new ATOM 1359 N ILE B 34 18.149 0.633 -9.941 1.00 0.00 N ATOM 1360 CA ILE B 34 17.894 -0.618 -10.637 1.00 0.00 C ATOM 1361 C ILE B 34 18.915 -1.644 -10.160 1.00 0.00 C ATOM 1362 O ILE B 34 20.118 -1.416 -10.276 1.00 0.00 O ATOM 1363 CB ILE B 34 17.997 -0.418 -12.158 1.00 0.00 C ATOM 1364 CG1 ILE B 34 16.976 0.599 -12.687 1.00 0.00 C ATOM 1365 CG2 ILE B 34 17.740 -1.758 -12.851 1.00 0.00 C ATOM 1366 CD1 ILE B 34 17.527 2.028 -12.683 1.00 0.00 C ATOM 0 H ILE B 34 19.126 0.926 -9.975 1.00 0.00 H new ATOM 0 HA ILE B 34 16.885 -0.969 -10.419 1.00 0.00 H new ATOM 0 HB ILE B 34 18.996 -0.037 -12.371 1.00 0.00 H new ATOM 0 HG12 ILE B 34 16.686 0.326 -13.702 1.00 0.00 H new ATOM 0 HG13 ILE B 34 16.074 0.557 -12.076 1.00 0.00 H new ATOM 0 HG21 ILE B 34 17.810 -1.629 -13.931 1.00 0.00 H new ATOM 0 HG22 ILE B 34 18.483 -2.485 -12.524 1.00 0.00 H new ATOM 0 HG23 ILE B 34 16.743 -2.116 -12.593 1.00 0.00 H new ATOM 0 HD11 ILE B 34 16.769 2.711 -13.066 1.00 0.00 H new ATOM 0 HD12 ILE B 34 17.792 2.313 -11.665 1.00 0.00 H new ATOM 0 HD13 ILE B 34 18.413 2.078 -13.316 1.00 0.00 H new ATOM 1378 N ASN B 35 18.447 -2.773 -9.624 1.00 0.00 N ATOM 1379 CA ASN B 35 19.327 -3.793 -9.077 1.00 0.00 C ATOM 1380 C ASN B 35 19.051 -5.153 -9.703 1.00 0.00 C ATOM 1381 O ASN B 35 18.015 -5.767 -9.455 1.00 0.00 O ATOM 1382 CB ASN B 35 19.174 -3.837 -7.559 1.00 0.00 C ATOM 1383 CG ASN B 35 20.234 -4.729 -6.930 1.00 0.00 C ATOM 1384 OD1 ASN B 35 21.400 -4.351 -6.854 1.00 0.00 O ATOM 1385 ND2 ASN B 35 19.842 -5.915 -6.475 1.00 0.00 N ATOM 0 H ASN B 35 17.455 -3.000 -9.560 1.00 0.00 H new ATOM 0 HA ASN B 35 20.359 -3.536 -9.318 1.00 0.00 H new ATOM 0 HB2 ASN B 35 19.254 -2.829 -7.152 1.00 0.00 H new ATOM 0 HB3 ASN B 35 18.182 -4.207 -7.300 1.00 0.00 H new ATOM 0 HD21 ASN B 35 20.519 -6.545 -6.045 1.00 0.00 H new ATOM 0 HD22 ASN B 35 18.864 -6.194 -6.556 1.00 0.00 H new ATOM 1392 N ALA B 36 20.002 -5.606 -10.517 1.00 0.00 N ATOM 1393 CA ALA B 36 19.978 -6.878 -11.223 1.00 0.00 C ATOM 1394 C ALA B 36 21.384 -7.479 -11.144 1.00 0.00 C ATOM 1395 O ALA B 36 22.345 -6.747 -10.904 1.00 0.00 O ATOM 1396 CB ALA B 36 19.572 -6.611 -12.671 1.00 0.00 C ATOM 0 H ALA B 36 20.848 -5.069 -10.709 1.00 0.00 H new ATOM 0 HA ALA B 36 19.266 -7.577 -10.785 1.00 0.00 H new ATOM 0 HB1 ALA B 36 19.547 -7.552 -13.221 1.00 0.00 H new ATOM 0 HB2 ALA B 36 18.584 -6.151 -12.693 1.00 0.00 H new ATOM 0 HB3 ALA B 36 20.295 -5.939 -13.134 1.00 0.00 H new ATOM 1402 N PRO B 37 21.537 -8.793 -11.341 1.00 0.00 N ATOM 1403 CA PRO B 37 22.839 -9.433 -11.327 1.00 0.00 C ATOM 1404 C PRO B 37 23.626 -9.052 -12.580 1.00 0.00 C ATOM 1405 O PRO B 37 23.056 -8.563 -13.554 1.00 0.00 O ATOM 1406 CB PRO B 37 22.536 -10.932 -11.292 1.00 0.00 C ATOM 1407 CG PRO B 37 21.195 -11.032 -12.018 1.00 0.00 C ATOM 1408 CD PRO B 37 20.478 -9.755 -11.586 1.00 0.00 C ATOM 0 HA PRO B 37 23.450 -9.128 -10.477 1.00 0.00 H new ATOM 0 HB2 PRO B 37 23.310 -11.512 -11.794 1.00 0.00 H new ATOM 0 HB3 PRO B 37 22.470 -11.306 -10.270 1.00 0.00 H new ATOM 0 HG2 PRO B 37 21.323 -11.077 -13.099 1.00 0.00 H new ATOM 0 HG3 PRO B 37 20.642 -11.925 -11.725 1.00 0.00 H new ATOM 0 HD2 PRO B 37 19.797 -9.403 -12.361 1.00 0.00 H new ATOM 0 HD3 PRO B 37 19.881 -9.922 -10.689 1.00 0.00 H new ATOM 1416 N LYS B 38 24.942 -9.273 -12.563 1.00 0.00 N ATOM 1417 CA LYS B 38 25.786 -9.011 -13.723 1.00 0.00 C ATOM 1418 C LYS B 38 25.523 -10.026 -14.836 1.00 0.00 C ATOM 1419 O LYS B 38 26.143 -9.955 -15.896 1.00 0.00 O ATOM 1420 CB LYS B 38 27.257 -9.003 -13.302 1.00 0.00 C ATOM 1421 CG LYS B 38 27.616 -7.696 -12.585 1.00 0.00 C ATOM 1422 CD LYS B 38 27.716 -6.543 -13.589 1.00 0.00 C ATOM 1423 CE LYS B 38 28.063 -5.237 -12.879 1.00 0.00 C ATOM 1424 NZ LYS B 38 29.393 -5.293 -12.244 1.00 0.00 N ATOM 0 H LYS B 38 25.445 -9.635 -11.753 1.00 0.00 H new ATOM 0 HA LYS B 38 25.539 -8.028 -14.125 1.00 0.00 H new ATOM 0 HB2 LYS B 38 27.455 -9.849 -12.644 1.00 0.00 H new ATOM 0 HB3 LYS B 38 27.891 -9.126 -14.180 1.00 0.00 H new ATOM 0 HG2 LYS B 38 26.860 -7.467 -11.834 1.00 0.00 H new ATOM 0 HG3 LYS B 38 28.564 -7.811 -12.059 1.00 0.00 H new ATOM 0 HD2 LYS B 38 28.477 -6.770 -14.336 1.00 0.00 H new ATOM 0 HD3 LYS B 38 26.770 -6.434 -14.120 1.00 0.00 H new ATOM 0 HE2 LYS B 38 28.037 -4.416 -13.596 1.00 0.00 H new ATOM 0 HE3 LYS B 38 27.308 -5.023 -12.122 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 29.686 -4.334 -11.966 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 29.350 -5.900 -11.400 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 30.083 -5.684 -12.917 1.00 0.00 H new ATOM 1438 N ASP B 39 24.607 -10.970 -14.600 1.00 0.00 N ATOM 1439 CA ASP B 39 24.158 -11.908 -15.619 1.00 0.00 C ATOM 1440 C ASP B 39 23.357 -11.170 -16.691 1.00 0.00 C ATOM 1441 O ASP B 39 23.115 -11.707 -17.769 1.00 0.00 O ATOM 1442 CB ASP B 39 23.272 -12.968 -14.963 1.00 0.00 C ATOM 1443 CG ASP B 39 22.928 -14.094 -15.935 1.00 0.00 C ATOM 1444 OD1 ASP B 39 23.879 -14.748 -16.419 1.00 0.00 O ATOM 1445 OD2 ASP B 39 21.720 -14.293 -16.187 1.00 0.00 O ATOM 0 H ASP B 39 24.158 -11.101 -13.693 1.00 0.00 H new ATOM 0 HA ASP B 39 25.023 -12.380 -16.084 1.00 0.00 H new ATOM 0 HB2 ASP B 39 23.782 -13.381 -14.093 1.00 0.00 H new ATOM 0 HB3 ASP B 39 22.354 -12.504 -14.604 1.00 0.00 H new ATOM 1450 N VAL B 40 22.949 -9.933 -16.385 1.00 0.00 N ATOM 1451 CA VAL B 40 22.166 -9.097 -17.279 1.00 0.00 C ATOM 1452 C VAL B 40 22.740 -7.682 -17.298 1.00 0.00 C ATOM 1453 O VAL B 40 23.644 -7.358 -16.525 1.00 0.00 O ATOM 1454 CB VAL B 40 20.691 -9.090 -16.851 1.00 0.00 C ATOM 1455 CG1 VAL B 40 20.160 -10.518 -16.708 1.00 0.00 C ATOM 1456 CG2 VAL B 40 20.482 -8.382 -15.516 1.00 0.00 C ATOM 0 H VAL B 40 23.161 -9.485 -15.493 1.00 0.00 H new ATOM 0 HA VAL B 40 22.218 -9.504 -18.289 1.00 0.00 H new ATOM 0 HB VAL B 40 20.152 -8.554 -17.632 1.00 0.00 H new ATOM 0 HG11 VAL B 40 19.114 -10.488 -16.404 1.00 0.00 H new ATOM 0 HG12 VAL B 40 20.246 -11.036 -17.663 1.00 0.00 H new ATOM 0 HG13 VAL B 40 20.742 -11.049 -15.954 1.00 0.00 H new ATOM 0 HG21 VAL B 40 19.424 -8.402 -15.255 1.00 0.00 H new ATOM 0 HG22 VAL B 40 21.057 -8.889 -14.741 1.00 0.00 H new ATOM 0 HG23 VAL B 40 20.816 -7.348 -15.597 1.00 0.00 H new ATOM 1466 N ALA B 41 22.215 -6.834 -18.183 1.00 0.00 N ATOM 1467 CA ALA B 41 22.704 -5.476 -18.322 1.00 0.00 C ATOM 1468 C ALA B 41 21.618 -4.467 -17.964 1.00 0.00 C ATOM 1469 O ALA B 41 20.435 -4.799 -17.918 1.00 0.00 O ATOM 1470 CB ALA B 41 23.202 -5.273 -19.753 1.00 0.00 C ATOM 0 H ALA B 41 21.449 -7.072 -18.813 1.00 0.00 H new ATOM 0 HA ALA B 41 23.531 -5.314 -17.630 1.00 0.00 H new ATOM 0 HB1 ALA B 41 23.572 -4.254 -19.868 1.00 0.00 H new ATOM 0 HB2 ALA B 41 24.007 -5.977 -19.961 1.00 0.00 H new ATOM 0 HB3 ALA B 41 22.382 -5.442 -20.451 1.00 0.00 H new ATOM 1476 N VAL B 42 22.042 -3.227 -17.710 1.00 0.00 N ATOM 1477 CA VAL B 42 21.161 -2.108 -17.418 1.00 0.00 C ATOM 1478 C VAL B 42 21.832 -0.833 -17.912 1.00 0.00 C ATOM 1479 O VAL B 42 22.958 -0.522 -17.528 1.00 0.00 O ATOM 1480 CB VAL B 42 20.811 -2.044 -15.922 1.00 0.00 C ATOM 1481 CG1 VAL B 42 21.974 -2.496 -15.038 1.00 0.00 C ATOM 1482 CG2 VAL B 42 20.382 -0.636 -15.504 1.00 0.00 C ATOM 0 H VAL B 42 23.030 -2.974 -17.703 1.00 0.00 H new ATOM 0 HA VAL B 42 20.211 -2.234 -17.937 1.00 0.00 H new ATOM 0 HB VAL B 42 19.977 -2.731 -15.779 1.00 0.00 H new ATOM 0 HG11 VAL B 42 21.680 -2.434 -13.990 1.00 0.00 H new ATOM 0 HG12 VAL B 42 22.237 -3.526 -15.281 1.00 0.00 H new ATOM 0 HG13 VAL B 42 22.835 -1.851 -15.212 1.00 0.00 H new ATOM 0 HG21 VAL B 42 20.142 -0.629 -14.441 1.00 0.00 H new ATOM 0 HG22 VAL B 42 21.195 0.064 -15.697 1.00 0.00 H new ATOM 0 HG23 VAL B 42 19.503 -0.339 -16.076 1.00 0.00 H new ATOM 1492 N HIS B 43 21.126 -0.097 -18.771 1.00 0.00 N ATOM 1493 CA HIS B 43 21.622 1.138 -19.361 1.00 0.00 C ATOM 1494 C HIS B 43 20.525 2.198 -19.406 1.00 0.00 C ATOM 1495 O HIS B 43 19.369 1.913 -19.095 1.00 0.00 O ATOM 1496 CB HIS B 43 22.200 0.843 -20.747 1.00 0.00 C ATOM 1497 CG HIS B 43 23.413 -0.045 -20.670 1.00 0.00 C ATOM 1498 ND1 HIS B 43 24.714 0.371 -20.480 1.00 0.00 N ATOM 1499 CD2 HIS B 43 23.423 -1.411 -20.767 1.00 0.00 C ATOM 1500 CE1 HIS B 43 25.484 -0.731 -20.428 1.00 0.00 C ATOM 1501 NE2 HIS B 43 24.745 -1.840 -20.609 1.00 0.00 N ATOM 0 H HIS B 43 20.186 -0.347 -19.077 1.00 0.00 H new ATOM 0 HA HIS B 43 22.421 1.544 -18.740 1.00 0.00 H new ATOM 0 HB2 HIS B 43 21.439 0.366 -21.364 1.00 0.00 H new ATOM 0 HB3 HIS B 43 22.466 1.780 -21.237 1.00 0.00 H new ATOM 0 HD2 HIS B 43 22.564 -2.044 -20.935 1.00 0.00 H new ATOM 0 HE1 HIS B 43 26.551 -0.726 -20.263 1.00 0.00 H new ATOM 0 HE2 HIS B 43 25.082 -2.803 -20.627 1.00 0.00 H new ATOM 1509 N ARG B 44 20.887 3.427 -19.793 1.00 0.00 N ATOM 1510 CA ARG B 44 19.990 4.568 -19.699 1.00 0.00 C ATOM 1511 C ARG B 44 19.694 5.195 -21.061 1.00 0.00 C ATOM 1512 O ARG B 44 20.517 5.894 -21.647 1.00 0.00 O ATOM 1513 CB ARG B 44 20.491 5.502 -18.581 1.00 0.00 C ATOM 1514 CG ARG B 44 20.928 6.928 -18.921 1.00 0.00 C ATOM 1515 CD ARG B 44 22.308 6.954 -19.565 1.00 0.00 C ATOM 1516 NE ARG B 44 22.754 8.322 -19.839 1.00 0.00 N ATOM 1517 CZ ARG B 44 22.309 9.089 -20.837 1.00 0.00 C ATOM 1518 NH1 ARG B 44 21.399 8.635 -21.696 1.00 0.00 N ATOM 1519 NH2 ARG B 44 22.776 10.327 -20.980 1.00 0.00 N ATOM 0 H ARG B 44 21.805 3.650 -20.177 1.00 0.00 H new ATOM 0 HA ARG B 44 18.991 4.258 -19.392 1.00 0.00 H new ATOM 0 HB2 ARG B 44 19.697 5.574 -17.837 1.00 0.00 H new ATOM 0 HB3 ARG B 44 21.336 5.009 -18.100 1.00 0.00 H new ATOM 0 HG2 ARG B 44 20.202 7.380 -19.597 1.00 0.00 H new ATOM 0 HG3 ARG B 44 20.938 7.532 -18.014 1.00 0.00 H new ATOM 0 HD2 ARG B 44 23.025 6.462 -18.908 1.00 0.00 H new ATOM 0 HD3 ARG B 44 22.286 6.386 -20.495 1.00 0.00 H new ATOM 0 HE ARG B 44 23.460 8.720 -19.219 1.00 0.00 H new ATOM 0 HH11 ARG B 44 21.032 7.689 -21.597 1.00 0.00 H new ATOM 0 HH12 ARG B 44 21.069 9.234 -22.453 1.00 0.00 H new ATOM 0 HH21 ARG B 44 23.472 10.688 -20.328 1.00 0.00 H new ATOM 0 HH22 ARG B 44 22.438 10.915 -21.742 1.00 0.00 H new